Phenylephrine hydrochloride supplier

Name
Phenylephrine hydrochloride
EINECS 200-517-3
CAS No. 61-76-7
Article Data13
CAS DataBase
Density
Solubility >=10 g/100 mL at 21 ºC
Melting Point 143-145 °C(lit.)
Formula C₉H₁₄ClNO₂
Boiling Point 341.1 °C at 760 mmHg
Molecular Weight 203.669
Flash Point 163.4 °C
Transport Information UN 3249
Appearance white to almost white crystalline powder
Safety 26-36-37/39
Risk Codes 22-36/37/38
Molecular Structure
Hazard Symbols Xn
Synonyms L(-)-Phenylephrine hydrochloride;(R)-(-)-1-(3-Hydroxyphenyl)-2-methylaminoethanol hydrochloride;3-Hydroxy-alpha-(methylaminomethyl)benzyl alcohol;
PSA 52.49000
LogP 1.83790

Synthetic route

: 74-89-5
methylamine

: 603983-68-2
3-((R)-1-Hydroxy-2-iodo-ethyl)-phenol

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Stage #1: methylamine; 3-((R)-1-Hydroxy-2-iodo-ethyl)-phenol In tetrahydrofuran; water at 20℃; for 3h; Stage #2: With hydrogenchloride at 20℃;	90%

: C13H21NO4

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
With hydrogenchloride In methanol for 1h; Reflux;	90%

: 94240-17-2
3-Hydroxyphenyl-ω-methylaminoacetophenone hydrochloride

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
With hydrogen; [Rh(cod)(R-Binapine)]BF4 In methanol at 65℃; under 21752.2 - 24752.5 Torr; for 18.25h; Product distribution / selectivity;	85%

: 59-42-7
Phenylephrin

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
With hydrogenchloride In isopropyl alcohol at 55 - 65℃; for 0.5h; Product distribution / selectivity;	84.5%
With hydrogenchloride In water; isopropyl alcohol pH=7 - 8; enantioselective reaction;	3.35 g

: (1R)-2-bromo-1-(3-hydroxylphenyl)ethanol

: 74-89-5
methylamine

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Stage #1: (1R)-2-bromo-1-(3-hydroxylphenyl)ethanol; methylamine In methanol for 6h; Inert atmosphere; Stage #2: With hydrogenchloride In methanol for 0.5h; Inert atmosphere;	74.8%

: 122709-71-1
(R)-2-(Benzyl-methyl-amino)-1-(3-benzyloxy-phenyl)-ethanol; hydrochloride

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
With hydrogen; palladium on activated charcoal at 3℃; under 7600 Torr; for 3h; Yield given;
With hydrogen; palladium on activated charcoal In ethanol at 50℃; under 7600 Torr; for 3h; Yield given;

: 96013-95-5
3-(tert-butyl-dimethyl-sylanyloxy)benzaldehyde

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 6 steps 1.1: 90 percent / tetrahydrofuran / 6 h / 20 °C 2.1: 97 percent / (DHQD)2PHAL; K3Fe(CH)6; K2CO3 / OsO4 / 2-methyl-propan-2-ol; H2O / 24 h / 0 °C 3.1: 98 percent / dibutyltin oxide; NEt3 / CH2Cl2 / 0.75 h / 20 °C 4.1: 90 percent / AcOH / H2O; tetrahydrofuran / 10 h / 60 °C 5.1: 98 percent / NaI / acetone / 6 h / Heating 6.1: H2O; tetrahydrofuran / 3 h / 20 °C 6.2: 90 percent / methanolic HCl / 20 °C View Scheme

Yield

Multi-step reaction with 6 steps
1.1: 90 percent / tetrahydrofuran / 6 h / 20 °C
2.1: 97 percent / (DHQD)2PHAL; K3Fe(CH)6; K2CO3 / OsO4 / 2-methyl-propan-2-ol; H2O / 24 h / 0 °C
3.1: 98 percent / dibutyltin oxide; NEt3 / CH2Cl2 / 0.75 h / 20 °C
4.1: 90 percent / AcOH / H2O; tetrahydrofuran / 10 h / 60 °C
5.1: 98 percent / NaI / acetone / 6 h / Heating
6.1: H2O; tetrahydrofuran / 3 h / 20 °C
6.2: 90 percent / methanolic HCl / 20 °C
View Scheme

: 100-83-4
meta-hydroxybenzaldehyde

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 7 steps 1.1: 90 percent / imidazole / CH2Cl2 / 5 h / 0 - 20 °C 2.1: 90 percent / tetrahydrofuran / 6 h / 20 °C 3.1: 97 percent / (DHQD)2PHAL; K3Fe(CH)6; K2CO3 / OsO4 / 2-methyl-propan-2-ol; H2O / 24 h / 0 °C 4.1: 98 percent / dibutyltin oxide; NEt3 / CH2Cl2 / 0.75 h / 20 °C 5.1: 90 percent / AcOH / H2O; tetrahydrofuran / 10 h / 60 °C 6.1: 98 percent / NaI / acetone / 6 h / Heating 7.1: H2O; tetrahydrofuran / 3 h / 20 °C 7.2: 90 percent / methanolic HCl / 20 °C View Scheme
Multi-step reaction with 5 steps 1.1: N-ethyl-N,N-diisopropylamine / dichloromethane / 3 h / 0 °C 2.1: sodium hydride / dimethyl sulfoxide; mineral oil / 0.25 h / 0 °C 2.2: 0.5 h / 20 °C 3.1: (R,R)-Jacobsen catalyst / water / 61 h / 0 - 20 °C / Resolution of racemate 4.1: methanol / 2 h / 20 °C 5.1: hydrogenchloride / methanol / 1 h / Reflux View Scheme

Yield

Multi-step reaction with 7 steps
1.1: 90 percent / imidazole / CH2Cl2 / 5 h / 0 - 20 °C
2.1: 90 percent / tetrahydrofuran / 6 h / 20 °C
3.1: 97 percent / (DHQD)2PHAL; K3Fe(CH)6; K2CO3 / OsO4 / 2-methyl-propan-2-ol; H2O / 24 h / 0 °C
4.1: 98 percent / dibutyltin oxide; NEt3 / CH2Cl2 / 0.75 h / 20 °C
5.1: 90 percent / AcOH / H2O; tetrahydrofuran / 10 h / 60 °C
6.1: 98 percent / NaI / acetone / 6 h / Heating
7.1: H2O; tetrahydrofuran / 3 h / 20 °C
7.2: 90 percent / methanolic HCl / 20 °C
View Scheme

Multi-step reaction with 5 steps
1.1: N-ethyl-N,N-diisopropylamine / dichloromethane / 3 h / 0 °C
2.1: sodium hydride / dimethyl sulfoxide; mineral oil / 0.25 h / 0 °C
2.2: 0.5 h / 20 °C
3.1: (R,R)-Jacobsen catalyst / water / 61 h / 0 - 20 °C / Resolution of racemate
4.1: methanol / 2 h / 20 °C
5.1: hydrogenchloride / methanol / 1 h / Reflux
View Scheme

: 149274-04-4
tert-butyldimethyl-(3-vinylphenoxy)silane

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 5 steps 1.1: 97 percent / (DHQD)2PHAL; K3Fe(CH)6; K2CO3 / OsO4 / 2-methyl-propan-2-ol; H2O / 24 h / 0 °C 2.1: 98 percent / dibutyltin oxide; NEt3 / CH2Cl2 / 0.75 h / 20 °C 3.1: 90 percent / AcOH / H2O; tetrahydrofuran / 10 h / 60 °C 4.1: 98 percent / NaI / acetone / 6 h / Heating 5.1: H2O; tetrahydrofuran / 3 h / 20 °C 5.2: 90 percent / methanolic HCl / 20 °C View Scheme

Yield

Multi-step reaction with 5 steps
1.1: 97 percent / (DHQD)2PHAL; K3Fe(CH)6; K2CO3 / OsO4 / 2-methyl-propan-2-ol; H2O / 24 h / 0 °C
2.1: 98 percent / dibutyltin oxide; NEt3 / CH2Cl2 / 0.75 h / 20 °C
3.1: 90 percent / AcOH / H2O; tetrahydrofuran / 10 h / 60 °C
4.1: 98 percent / NaI / acetone / 6 h / Heating
5.1: H2O; tetrahydrofuran / 3 h / 20 °C
5.2: 90 percent / methanolic HCl / 20 °C
View Scheme

: 603983-65-9
1-[3-(tert-butyl-dimethyl-silanyloxy)-phenyl]-ethane-1,2-diol

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1.1: 98 percent / dibutyltin oxide; NEt3 / CH2Cl2 / 0.75 h / 20 °C 2.1: 90 percent / AcOH / H2O; tetrahydrofuran / 10 h / 60 °C 3.1: 98 percent / NaI / acetone / 6 h / Heating 4.1: H2O; tetrahydrofuran / 3 h / 20 °C 4.2: 90 percent / methanolic HCl / 20 °C View Scheme

: 603983-67-1
Toluene-4-sulfonic acid (R)-2-hydroxy-2-(3-hydroxy-phenyl)-ethyl ester

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1.1: 98 percent / NaI / acetone / 6 h / Heating 2.1: H2O; tetrahydrofuran / 3 h / 20 °C 2.2: 90 percent / methanolic HCl / 20 °C View Scheme

: 603983-66-0
toluene-4-sulfonic acid 2-[3-(tert-butyl-dimethyl-silanyloxy)-phenyl]-2-hydroxy-ethyl ester

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1.1: 90 percent / AcOH / H2O; tetrahydrofuran / 10 h / 60 °C 2.1: 98 percent / NaI / acetone / 6 h / Heating 3.1: H2O; tetrahydrofuran / 3 h / 20 °C 3.2: 90 percent / methanolic HCl / 20 °C View Scheme

: 122709-70-0
3'-benzyloxy-2-(N-benzyl-N-methyl)aminoacetophenone hydrochloride

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: H2, 2, (2R,4R)-N-(methylcarbamoyl)-4-(dicyclohexylphosphino)-2-<(diphenylphosphino)methyl>pyrrolidine, triethylamine / methanol / 20 h / 50 °C / 15200 Torr 2: H2 / 10percent Pd/C / ethanol / 3 h / 50 °C / 7600 Torr View Scheme
Multi-step reaction with 2 steps 1: 100 percent / H2, triethylamine / <(Rh(COD)Cl>2, (2R,4R)-MCCPM / CH2Cl2 / 20 h / 50 °C / 15200 Torr 2: H2 / 10percent Pd/C / 3 h / 3 °C / 7600 Torr View Scheme

: 1159977-09-9
2-(benzyl(methyl)amino)-1-(3'-hydroxyphenyl)ethanol

: 71786-67-9
2-(benzyl(methyl)amino)-1-(3'-hydroxyphenyl)ethanone hydrochloride

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
With hydrogen; triethylamine In methanol

: 94240-17-2
3-Hydroxyphenyl-ω-methylaminoacetophenone hydrochloride

A: 61-76-7
phenylephrine hydrochloride

B: 939-38-8
(+)-Phenylephrine hydrochloride

Conditions

Conditions	Yield
With hydrogen; [(S)-Xyl-P-Phos RuCl(p-cymene)]Cl In methanol at 80 - 85℃; under 18751.9 - 23252.3 Torr; for 21h; Product distribution / selectivity;	A n/a B n/a

: 154-86-9
phenylephrine hydrochloride

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1.1: sodium hydroxide / methanol / 0.5 h / 20 °C 1.2: 1.5 h / 25 - 60 °C / Resolution of racemate 2.1: hydrogenchloride / toluene; water / 0.5 h / 75 - 80 °C / pH < 2 2.2: 1 - 15 °C / pH ~ 9 3.1: hydrogenchloride / isopropyl alcohol / 0.5 h / 55 - 65 °C View Scheme

: 1477-63-0
Phenylephrine

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1.1: methanol / 2 h / 20 - 65 °C / Resolution of racemate 2.1: hydrogenchloride / toluene; water / 0.5 h / 75 - 80 °C / pH < 2 2.2: 1 - 15 °C / pH ~ 9 3.1: hydrogenchloride / isopropyl alcohol / 0.5 h / 55 - 65 °C View Scheme

: 1280541-42-5
(R)-phenylephrine-(R)-naproxen

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1.1: hydrogenchloride / toluene; water / 0.5 h / 75 - 80 °C / pH < 2 1.2: 1 - 15 °C / pH ~ 9 2.1: hydrogenchloride / isopropyl alcohol / 0.5 h / 55 - 65 °C View Scheme

: 139461-72-6
(3-methoxyethoxymethyloxy)benzaldehyde

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1.1: sodium hydride / dimethyl sulfoxide; mineral oil / 0.25 h / 0 °C 1.2: 0.5 h / 20 °C 2.1: (R,R)-Jacobsen catalyst / water / 61 h / 0 - 20 °C / Resolution of racemate 3.1: methanol / 2 h / 20 °C 4.1: hydrogenchloride / methanol / 1 h / Reflux View Scheme

: 1-(3-methoxyethoxymethyloxy)phenylethylene oxide

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: (R,R)-Jacobsen catalyst / water / 61 h / 0 - 20 °C / Resolution of racemate 2: methanol / 2 h / 20 °C 3: hydrogenchloride / methanol / 1 h / Reflux View Scheme

: 2454-35-5
3-acetylphenyl acetate

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1.1: bromine; aluminum (III) chloride / diethyl ether / -10 °C 2.1: borane-THF; (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole / toluene; tetrahydrofuran / 20 °C / Inert atmosphere 2.2: 0 °C / Inert atmosphere 3.1: methanol / 6 h / Inert atmosphere 3.2: 0.5 h / Inert atmosphere View Scheme
Multi-step reaction with 3 steps 1.1: bromine; aluminum (III) chloride / diethyl ether / -10 °C 2.1: borane-THF; (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole / toluene; tetrahydrofuran / 20 °C / Inert atmosphere 2.2: 0 °C / Inert atmosphere 3.1: methanol / 6 h / Inert atmosphere 3.2: 0.5 h / Inert atmosphere View Scheme
Multi-step reaction with 4 steps 1.1: bromine; aluminum (III) chloride / diethyl ether / -10 °C 2.1: sodium hydrogencarbonate / methanol 3.1: borane-THF; (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole / toluene; tetrahydrofuran / 20 °C / Inert atmosphere 3.2: 0 °C / Inert atmosphere 4.1: methanol / 6 h / Inert atmosphere 4.2: 0.5 h / Inert atmosphere View Scheme

: 38396-89-3
2-bromo-3-acetyloxylacetophenone

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1.1: borane-THF; (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole / toluene; tetrahydrofuran / 20 °C / Inert atmosphere 1.2: 0 °C / Inert atmosphere 2.1: methanol / 6 h / Inert atmosphere 2.2: 0.5 h / Inert atmosphere View Scheme
Multi-step reaction with 2 steps 1.1: borane-THF; (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole / toluene; tetrahydrofuran / 20 °C / Inert atmosphere 1.2: 0 °C / Inert atmosphere 2.1: methanol / 6 h / Inert atmosphere 2.2: 0.5 h / Inert atmosphere View Scheme
Multi-step reaction with 3 steps 1.1: sodium hydrogencarbonate / methanol 2.1: borane-THF; (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole / toluene; tetrahydrofuran / 20 °C / Inert atmosphere 2.2: 0 °C / Inert atmosphere 3.1: methanol / 6 h / Inert atmosphere 3.2: 0.5 h / Inert atmosphere View Scheme

: 121-71-1
3-Hydroxyacetophenone

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1.1: sodium hydroxide / water / 1.5 h / 0 °C / pH 7 - 8 2.1: bromine; aluminum (III) chloride / diethyl ether / -10 °C 3.1: borane-THF; (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole / toluene; tetrahydrofuran / 20 °C / Inert atmosphere 3.2: 0 °C / Inert atmosphere 4.1: methanol / 6 h / Inert atmosphere 4.2: 0.5 h / Inert atmosphere View Scheme
Multi-step reaction with 4 steps 1.1: sodium hydroxide / water / 1.5 h / 0 °C / pH 7 - 8 2.1: bromine; aluminum (III) chloride / diethyl ether / -10 °C 3.1: borane-THF; (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole / toluene; tetrahydrofuran / 20 °C / Inert atmosphere 3.2: 0 °C / Inert atmosphere 4.1: methanol / 6 h / Inert atmosphere 4.2: 0.5 h / Inert atmosphere View Scheme
Multi-step reaction with 5 steps 1.1: sodium hydroxide / water / 1.5 h / 0 °C / pH 7 - 8 2.1: bromine; aluminum (III) chloride / diethyl ether / -10 °C 3.1: sodium hydrogencarbonate / methanol 4.1: borane-THF; (3aR)-1-methyl-3,3-diphenyl-tetrahydro-pyrrolo[1,2-c][1,3,2]oxazaborole / toluene; tetrahydrofuran / 20 °C / Inert atmosphere 4.2: 0 °C / Inert atmosphere 5.1: methanol / 6 h / Inert atmosphere 5.2: 0.5 h / Inert atmosphere View Scheme
Multi-step reaction with 3 steps 1.1: sulfuryl dichloride / dichloromethane / 2 h / 5 - 25 °C 2.1: (1R,2S)-1-Amino-2-indanol; borane-THF / tetrahydrofuran / 0.5 h / 20 - 25 °C 3.1: water; methanol / 30 - 40 °C 3.2: 0.5 h / 0 - 50 °C View Scheme

: 74-89-5
methylamine

: 925430-39-3
(R)-2-chloro-1-(3-hydroxyphenyl)ethanol

: 61-76-7
phenylephrine hydrochloride

Conditions

Conditions	Yield
Stage #1: methylamine; (R)-2-chloro-1-(3-hydroxyphenyl)ethanol In methanol; water at 30 - 40℃; Stage #2: With hydrogenchloride In methanol; water at 0 - 50℃; for 0.5h;

: 61-76-7
phenylephrine hydrochloride

: 79060-88-1
sodium tetrakis[(3,5-di-trifluoromethyl)phenyl]borate

: C9H13NO2*C32H12BF24(1-)*H(1+)

Conditions

Conditions	Yield
In chloroform at 20℃; for 1h;	97%

: 61-76-7
phenylephrine hydrochloride

: 636-87-3
(-)-m-octopamine

Conditions

Conditions	Yield
for 9h; Irradiation;	96.1%

: 61-76-7
phenylephrine hydrochloride

: 88-10-8
N,N-diethylcarbamyl chloride

: 112023-62-8
(1R)-1-(3-hydroxyphenyl)-2-ethanol

Conditions

Conditions	Yield
With triethylamine In tetrahydrofuran for 1h;	76%

: 61-76-7
phenylephrine hydrochloride

: 106-96-7
propargyl bromide

: 110193-52-7
(R)-3-hydroxy-α-<(methyl-2-propanoylamino)methyl>benzenemethanol

Conditions

Conditions	Yield
With triethylamine In tetrahydrofuran; toluene for 16h;	64%

: 61-76-7
phenylephrine hydrochloride

: 105-58-8
Diethyl carbonate

: 110193-49-2
(R)-5-(3-hydroxyphenyl)-3-methyl-2-oxazolidone

Conditions

Conditions	Yield
With potassium carbonate for 4h; Heating;	51%

: 61-76-7
phenylephrine hydrochloride

: 105-58-8
Diethyl carbonate

: 112710-46-0
5-(3-hydroxyphenyl)-3-methyl-2-oxazolidone

Conditions

Conditions	Yield
With potassium carbonate In acetone	51%

: 61-76-7
phenylephrine hydrochloride

: 16420-13-6
N,N-Dimethylthiocarbamoyl chloride

: 110193-50-5
(R)-1-(3-hydroxyphenyl)-2-ethanol

Conditions

Conditions	Yield
With triethylamine In tetrahydrofuran for 2h;	47%

: 61-76-7
phenylephrine hydrochloride

: 16420-13-6
N,N-Dimethylthiocarbamoyl chloride

: 112636-20-1
1-(3-Hydroxyphenyl)-2-(N-methyl-N-dimethylthiocarbamoyl)amino ethanol

Conditions

Conditions	Yield
With triethylamine In tetrahydrofuran; hexane; dichloromethane	47%

: 773837-37-9
sodium cyanide

: 61-76-7
phenylephrine hydrochloride

: (R)-2-((2-hydroxy-2-(3-hydroxyphenyl)ethyl)amino)acetonitrile

Conditions

Conditions	Yield
With [4,4’-bis(1,1-dimethylethyl)-2,2’-bipyridine-N1,N1‘]bis [3,5-difluoro-2-[5-(trifluoromethyl)-2-pyridinyl-N]phenyl-C]iridium(III) hexafluorophosphate; acetic acid In acetonitrile at 20℃; for 24h; Irradiation; Sealed tube;	26%

: 61-76-7
phenylephrine hydrochloride

: 105578-87-8
7α-hydroxyendesm-4-en-6,12-olide

: 1109276-29-0
(3aR,5aR,9bS)-3a-hydroxy-3-((((2R)-2-hydroxy-2-(3-hydroxyphenyl)ethyl)(methyl)amino)methyl)-5a,9-dimethyl-3,3a,4,5,5a,6,7,8-octahydronaphtho[1,2-b]furan-2(9bH)-one

Conditions

Conditions	Yield
With triethylamine In ethanol at 25℃; for 15h;	21.3%

: 14254-57-0
4-(chlorocarbonyl)pyridine

: 61-76-7
phenylephrine hydrochloride

: N-[(R)-2-Hydroxy-2-(3-hydroxy-phenyl)-ethyl]-N-methyl-isonicotinamide

Conditions

Conditions	Yield
With triethylamine In tetrahydrofuran for 1h;

: 79-03-8
propionyl chloride

: 61-76-7
phenylephrine hydrochloride

: N-[(R)-2-Hydroxy-2-(3-hydroxy-phenyl)-ethyl]-N-methyl-propionamide

Conditions

Conditions	Yield
With triethylamine In tetrahydrofuran for 1h;

: 541-41-3
chloroformic acid ethyl ester

: 61-76-7
phenylephrine hydrochloride

: [(R)-2-Hydroxy-2-(3-hydroxy-phenyl)-ethyl]-methyl-carbamic acid ethyl ester

Conditions

Conditions	Yield
With triethylamine In tetrahydrofuran for 1h;

: 61-76-7
phenylephrine hydrochloride

: 85665-59-4
(S)-methyl 1-(chlorocarbonyl)pyrrolidine-2-carboxylate

: (S)-1-{[(R)-2-Hydroxy-2-(3-hydroxy-phenyl)-ethyl]-methyl-carbamoyl}-pyrrolidine-2-carboxylic acid methyl ester

Conditions

Conditions	Yield
With triethylamine In tetrahydrofuran for 1h;

: 61-76-7
phenylephrine hydrochloride

: 83-01-2
diphenylcarbamic chloride

: 1-[(R)-2-Hydroxy-2-(3-hydroxy-phenyl)-ethyl]-1-methyl-3,3-diphenyl-urea

Conditions

Conditions	Yield
With triethylamine In tetrahydrofuran for 1h;

: 61-76-7
phenylephrine hydrochloride

: 13360-57-1
dimethylamino sulfonyl chloride

: C11H18N2O4S

Conditions

Conditions	Yield
With triethylamine In tetrahydrofuran for 1h;

: 61-76-7
phenylephrine hydrochloride

: 79-44-7
N,N-Dimethylcarbamoyl chloride

: 1-[(R)-2-Hydroxy-2-(3-hydroxy-phenyl)-ethyl]-1,3,3-trimethyl-urea

Conditions

Conditions	Yield
With triethylamine In tetrahydrofuran for 1h;

aqueous potassium hydroxide: aqueous potassium hydroxide

: 61-76-7
phenylephrine hydrochloride

: 10294-56-1
phosphorous acid

: 71-36-3
butan-1-ol

: 51674-33-0
2-(3-Hydroxyphenyl)-methylaminoethane

Conditions

Conditions	Yield
With hydrogen iodide; sodium sulfate	23.72 g (62.7%)

...Expand

Phenylephrine hydrochloride Consensus Reports

Reported in EPA TSCA Inventory.

Phenylephrine hydrochloride Specification

This chemical is called Phenylephrine hydrochloride, and its systematic name is Benzenemethanol, 3-hydroxy-alpha-((methylamino)methyl)-, hydrochloride (1:1), (alphaR)-. With the CAS registry number of 61-76-7, its classification codes are Adrenergic [ophthalmic]; Diagnostic aid [radiopaque medium, cholecystographic]; Drug / Therapeutic Agent; Human Data; Mutation data; Reproductive Effect; Tumor data. Additionally, this chemical is soluble in water and ethanol, insoluble in chloroform and ethyl ether.

Other characteristics of the Phenylephrine hydrochloride can be summarised as followings: (1)ACD/LogP: -0.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.05; (4)ACD/LogD (pH 7.4): -1.92; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 18.46 Å²; (13)Flash Point: 163.4 °C; (14)Enthalpy of Vaporization: 61.71 kJ/mol; (15)Boiling Point: 341.1 °C at 760 mmHg; (16)Vapour Pressure: 3.18E-05 mmHg at 25°C.

Uses of this chemical: The Phenylephrine hydrochloride is an alpha-adrenergic agonist served as a mydriatic, nasal decongestant, and cardiotonic agent. It's used as drenergic drugs, having contraction effect on blood vessels of local body. It's also used for swelling and inflammation of nasal congestion, Extending anesthesia time.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: [Cl-].O[C@H](c1cc(O)ccc1)C[NH2+]C
2.InChI: InChI=1/C9H13NO2.ClH/c1-10-6-9(12)7-3-2-4-8(11)5-7;/h2-5,9-12H,6H2,1H3;1H/t9-;/m0./s1
3.InChIKey:OCYSGIYOVXAGKQ-FVGYRXGTBL

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
dog	LDLo	intraperitoneal	16mg/kg (16mg/kg)		International Journal of Neuropharmacology. Vol. 4, Pg. 219, 1965.
man	TDLo	ocular	120mg/kg (120mg/kg)	BRAIN AND COVERINGS: "CHANGES IN CIRCULATION (HEMORRHAGE, THROMBOSIS, ETC.)" BEHAVIORAL: MUSCLE WEAKNESS	Southern Medical Journal. Vol. 86, Pg. 1064, 1993.
mouse	LD50	intraperitoneal	89mg/kg (89mg/kg)		Toxicology and Applied Pharmacology. Vol. 28, Pg. 227, 1974.
mouse	LD50	intravenous	1120ug/kg (1.12mg/kg)	BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES LUNGS, THORAX, OR RESPIRATION: DYSPNEA	European Journal of Pharmacology. Vol. 9, Pg. 289, 1970.
mouse	LD50	oral	120mg/kg (120mg/kg)		International Journal of Neuropharmacology. Vol. 4, Pg. 219, 1965.
mouse	LD50	subcutaneous	22mg/kg (22mg/kg)		Journal of Pharmacology and Experimental Therapeutics. Vol. 86, Pg. 284, 1946.
rabbit	LD50	intramuscular	7200ug/kg (7.2mg/kg)		Journal of Pharmacology and Experimental Therapeutics. Vol. 86, Pg. 284, 1946.
rabbit	LD50	intravenous	500ug/kg (0.5mg/kg)		Journal of Pharmacology and Experimental Therapeutics. Vol. 86, Pg. 284, 1946.
rabbit	LD50	subcutaneous	22mg/kg (22mg/kg)		Journal of Pharmacology and Experimental Therapeutics. Vol. 86, Pg. 284, 1946.
rat	LD50	intraperitoneal	17mg/kg (17mg/kg)		Journal of Pharmacology and Experimental Therapeutics. Vol. 86, Pg. 284, 1946.
rat	LD50	intravenous	440ug/kg (0.44mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD	Journal of Pharmacology and Experimental Therapeutics. Vol. 113, Pg. 341, 1955.
rat	LD50	oral	350mg/kg (350mg/kg)		Archives Internationales de Pharmacodynamie et de Therapie. Vol. 180, Pg. 155, 1969.
rat	LD50	subcutaneous	27mg/kg (27mg/kg)		Journal of Pharmacology and Experimental Therapeutics. Vol. 86, Pg. 284, 1946.

Product Name

Phenylephrine hydrochloride

Synthetic route

Phenylephrine hydrochloride Consensus Reports

Phenylephrine hydrochloride Specification

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