3-Aminophenol supplier | CasNO.591-27-5

Name
3-Aminophenol
EINECS 209-711-2
CAS No. 591-27-5
Article Data214
CAS DataBase
Density 1.2±0.1 g/cm³
Solubility Soluble in hot water, ethanol, ethyl ether and pentanol, slightly soluble in water and benzene
Melting Point 121 °C
Formula C₆H₇NO
Boiling Point 298.566 °C at 760 mmHg
Molecular Weight 109.128
Flash Point 116.4±19.8 °C
Transport Information UN 2512 6.1/PG 3
Appearance White crystals or off-white flakes
Safety 28-61
Risk Codes 20/22-51/53
Molecular Structure
Hazard Symbols Xn,N
Synonyms Phenol,m-amino- (8CI);(3-Hydroxyphenyl)amine;1-Amino-3-hydroxybenzene;3-Hydroxybenzenamine;C.I. OxidationBase 7;Fourrine 65;Fourrine EG;Nako TEG;m-Hydroxyphenylamine;
PSA 46.25000
LogP 1.55560

Synthetic route

: 554-84-7
meta-nitrophenol

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With hydrogen In ethanol at 60℃; under 7500.75 Torr; for 2h;	100%
With palladium on activated charcoal; hydrogen In methanol at 20℃; for 12h;	100%
With sodium tetrahydroborate In methanol; water at 20℃; for 3h;	100%

: 147985-36-2
m-tetrahydropyran-2-yloxyaminobenzene

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With β‐cyclodextrin In water at 60℃; for 0.133333h; Microwave irradiation;	99%
With ytterbium(III) chloride In neat (no solvent) at 70 - 120℃; for 0.0333333h; Microwave irradiation; Green chemistry;	95%

: 24318-00-1
3-(benzyloxy)nitrobenzol

A: 1484-26-0
3-(benzyloxy)aniline

B: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With pyrrolidine; hydrogen; 5% rhodium-on-charcoal; iron(II) acetate In tetrahydrofuran at 20℃; for 2.5h;	A 98% B 0.5%
With hydrogen; 5% rhodium-on-charcoal; nickel(II) nitrate In tetrahydrofuran; water at 20℃; for 15h;	A 92% B 2%
With hydrogen; 5% rhodium-on-charcoal; iron(II) acetate In tetrahydrofuran at 20℃; for 33h;	A 92% B 0.8%

: 96649-05-7
3-(methoxymethoxy)aniline

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With β‐cyclodextrin In water at 60℃; for 0.15h; Microwave irradiation;	98%
With ytterbium(III) chloride In neat (no solvent) at 70 - 120℃; for 0.0333333h; Microwave irradiation; Green chemistry;	93%

: 51642-25-2
3-azidophenol

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With ammonium hydroxide at 90℃; for 1h;	97%
With aluminium(III) iodide In benzene for 0.25h; Reduction; Heating;	92%
With triphenylphosphine-2-carboxamide In tetrahydrofuran; water at 20℃; for 2h; Staudinger Azide Reduction;	90%

: 100367-37-1
3-amino-4-bromophenol

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With sodium sulfite In water at 60℃; for 18h; Green chemistry;	96%

: 19962-06-2
tert-butyl 3-hydroxyphenylcarbamate

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With water at 100℃; for 1h;	95%

: 626-02-8
3-Iodophenol

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With [Cu2(2,7-bis(pyridin-2-yl)-l,8-naphthyridine)(OH)(CF3COO)3]; tetrabutylammomium bromide; ammonia; caesium carbonate In water at 110 - 120℃; for 16h; Sealed tube;	95%

: 108-45-2
m-phenylenediamine

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With sulfuric acid; sodium nitrite at 10 - 90℃;	92.8%
Diazotization.ueber mehrere Stufen;

: 121942-75-4
3-[(tert-butyldimethylsilyl)oxy]aniline

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With sodium phosphate dodecahydrate In N,N-dimethyl-formamide at 20℃; for 2h;	92%
With potassium hydroxide In ethanol at 20℃; for 2h;	91%

: 24318-00-1
3-(benzyloxy)nitrobenzol

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With 5%-palladium/activated carbon; hydrogen In ethanol at 60℃; under 3000.3 Torr; for 3h;	92%

: 100367-36-0
2-bromo-3-hydroxyaniline

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With sodium sulfite In water at 60℃; for 18h; Green chemistry;	91%

: 30418-59-8
3-Aminophenylboronic acid

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With 1,10-Phenanthroline; copper(II) sulfate; potassium hydroxide In water at 20℃; for 3h;	90%
With water; caesium carbonate; hydrazine hydrate at 80℃; for 12h;	85%
With oxygen; N-ethyl-N,N-diisopropylamine In acetone at 25℃; under 760.051 Torr; for 65h; Catalytic behavior; Irradiation;	32 %Chromat.

: 121942-75-4
3-[(tert-butyldimethylsilyl)oxy]aniline

Cs2CO3: Cs2CO3

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
In water; N,N-dimethyl-formamide at 20℃; for 3h;	88%

: 51581-40-9
3-pyridyl diethylcarbamate

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With zirconocene dichloride In tetrahydrofuran at 20℃; Inert atmosphere;	87%

: 1484-26-0
3-(benzyloxy)aniline

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With 10% Pd/C; cyclohexa-1,4-diene In ethyl acetate at 100℃; for 0.5h; Microwave irradiation;	86%
In ethanol for 2h; Cooling with ice;	48%
Multi-step reaction with 2 steps 1: 94 percent 2: 71.4 percent / TFSA / trifluoroacetic acid / 0 °C View Scheme

: 107826-08-4
3-azidophenyl benzyl ether

A: 1484-26-0
3-(benzyloxy)aniline

B: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With trifluorormethanesulfonic acid In trifluoroacetic acid at 0℃;	A 28.5% B 71.4%

: 5220-49-5
3-amino-cyclohex-2-enone

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With mercury(II) diacetate In acetonitrile for 20h; Heating;	56%

: 108-46-3
recorcinol

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With 5%-palladium/activated carbon; hydrazine hydrate; lithium hydroxide In 1,4-dioxane at 170℃; for 16h; Molecular sieve; Inert atmosphere;	44%
With ammonium hydroxide; ammonium chloride at 200℃;
With ammonium chloride; ammonia at 200℃;

: 30418-59-8
3-Aminophenylboronic acid

A: 2243-47-2
3-biphenyl amine

B: 2050-89-7
3,3'-diaminobiphenyl

C: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With tetrakis(triphenylphosphine) palladium(0) In toluene for 20h; Dimerization; Heating;	A 5% B 44% C 14%

...Expand

: 51985-06-9
3-hydroxy-alpha-methylstyrene

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
Stage #1: 3-hydroxy-alpha-methylstyrene With sodium azide; sulfuric acid In hexane; water at 20 - 40℃; for 4h; Stage #2: With sodium hydroxide In water at 0℃; for 0.333333h; Reagent/catalyst;	40%

: 62-53-3
aniline

A: 123-30-8
4-amino-phenol

B: 95-55-6
2-amino-phenol

C: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With hydrogen fluoride; dihydrogen peroxide; antimony pentafluoride at -20℃; for 0.25h;	A 14% B 20.5% C 36%
With dihydrogen peroxide; antimony pentafluoride In hydrogen fluoride at -20℃; for 0.25h;	A 14% B 20.5% C 36%
With dihydrogen peroxide; antimony pentafluoride In hydrogen fluoride at -20℃; for 0.25h; Mechanism; Product distribution;	A 14% B 20.5% C 36%
With bismuth(III) oxobromide; 18O-labeled water; oxygen-18 Reagent/catalyst; Photolysis;

...Expand

: 619-19-2
2-hydroxy-4-nitrobenzoic acid

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
mit den ueblichen Reduktionsmitteln;
bei Einw. der ueblichen Reduktionsmittel;

: 4-(3-hydroxy-anilino)-pent-3-en-2-one

: furan-2,3,5(4H)-trione pyridine (1:1)

A: 64-19-7
acetic acid

B: 67-64-1
acetone

C: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
bei der Destillation;

...Expand

: 121-47-1
3-aminobenzenesulfonic acid

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With sodium hydroxide; water at 280 - 290℃;
With sodium hydroxide at 280 - 290℃;
With sodium hydroxide; water at 280 - 290℃;

: 108-46-3
recorcinol

A: 108-45-2
m-phenylenediamine

B: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With aluminum oxide; ammonia at 420℃;

: 938-10-3
phenylsulfonyl azide

: 108-95-2
phenol

A: 123-30-8
4-amino-phenol

B: 95-55-6
2-amino-phenol

C: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
at 120℃; Product distribution; anschl. Erwaermen mit wss. HCl;

...Expand

: 554-84-7
meta-nitrophenol

A: 10603-61-9
m-hydroxyphenyl-hydroxylamine

B: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
In water at 25℃; Product distribution; Mechanism; electrochemical reduction in buffered aqueous solution; pH dependence;
In ethanol; water at 25℃; Rate constant; Mechanism; Product distribution; polarographic reduction; potential-dependent rate constants kf,h, αna; pH = 1.81-11.00;

: 10603-61-9
m-hydroxyphenyl-hydroxylamine

: 591-27-5
m-Hydroxyaniline

Conditions

Conditions	Yield
With Britton-Robbinson buffer; N-dodecylpyridinium chloride In ethanol at 25℃; Kinetics; Mechanism; electric current;
With Britton-Robbinson buffer; sodium dodecyl-sulfate In ethanol at 25℃; Kinetics; Mechanism; electric current;
With Britton-Robbinson buffer; Triton X-100 In ethanol at 25℃; Kinetics; Mechanism; electric current;

: 108-24-7
acetic anhydride

: 591-27-5
m-Hydroxyaniline

: 621-42-1
meta-hydroxyacetanilide

Conditions

Conditions	Yield
In tetrahydrofuran at 20℃; for 2h;	100%
In tetrahydrofuran at 20℃; for 2h;	100%
With triethylamine In diethyl ether at 20℃; for 18h;	99%

: 141-97-9
ethyl acetoacetate

: 591-27-5
m-Hydroxyaniline

: 26093-31-2
7-amino-4-methylcoumarin.

Conditions

Conditions	Yield
With zirconium(IV) phosphate at 110℃; for 0.166667h; Pechmann condensation; Microwave irradiation; chemoselective reaction;	100%
With silica gel supported zirconyl chloride octahydrate at 90℃; for 0.583333h; Pechmann condensation reaction;	98%
With tetrakis(actonitrile)copper(I) hexafluorophosphate at 25℃; for 0.166667h; Pechmann condensation; neat (no solvent);	98%

: 1120-71-4
1,3-propanesultone

: 591-27-5
m-Hydroxyaniline

: 52962-41-1
3-((3-hydroxyphenyl)amino)propane-1-sulfonic acid

Conditions

Conditions	Yield
In acetonitrile at 20℃;	100%
In butan-1-ol for 0.5h; Heating;	80%
for 0.5h; Reflux;	80%

: 999-97-3
1,1,1,3,3,3-hexamethyl-disilazane

: 591-27-5
m-Hydroxyaniline

: 36309-43-0
3-((trimethylsilyl)oxy)aniline

Conditions

Conditions	Yield
phosphotungstic acid at 55 - 60℃; for 0.75h;	100%
With phosphotungstic acid at 55 - 60℃; for 0.75h;	99%
With silica triflate at 20℃; for 0.0333333h;	90%

: 120-14-9
3,4-dimethoxy-benzaldehyde

: 591-27-5
m-Hydroxyaniline

: 23837-30-1
3,4-Methoxybenzyliden-m-hydroxyanilin

Conditions

Conditions	Yield
In toluene Heating;	100%

: 18162-48-6
tert-butyldimethylsilyl chloride

: 591-27-5
m-Hydroxyaniline

: 121942-75-4
3-[(tert-butyldimethylsilyl)oxy]aniline

Conditions

Conditions	Yield
With 1H-imidazole In tetrahydrofuran at 20℃; Inert atmosphere;	100%
With 1H-imidazole In dichloromethane at 20℃; for 15h;	99%
With dmap; triethylamine In dichloromethane at 20℃; for 6h;	99.93%

: 501-53-1
benzyl chloroformate

: 591-27-5
m-Hydroxyaniline

: 19972-88-4
3-Hydroxycarbanilic Acid Benzyl Ester

Conditions

Conditions	Yield
In diethyl ether for 18h; Ambient temperature;	100%
With sodium hydrogencarbonate In 1,4-dioxane; water at 0 - 20℃; for 13h;	68%
With triethylamine In diethyl ether at 20℃; for 18h;	51%
With sodium carbonate In tetrahydrofuran; water at 0 - 20℃; for 1h;

: 16801-19-7
2-[2-(vinyloxy)ethoxymethyl]oxirane

: 591-27-5
m-Hydroxyaniline

: 3-[2-Hydroxy-3-(2-vinyloxy-ethoxy)-propylamino]-phenol

Conditions

Conditions	Yield
at 40 - 50℃; for 1h;	100%

: 24424-99-5
di-tert-butyl dicarbonate

: 591-27-5
m-Hydroxyaniline

: 19962-06-2
tert-butyl 3-hydroxyphenylcarbamate

Conditions

Conditions	Yield
In tetrahydrofuran Reflux;	100%
With triethylamine	99%
In tetrahydrofuran for 24h; Heating;	96%

: 107866-54-6
1-acetyl-1H-1,2,3-triazolo<4,5-b>pyridine

: 591-27-5
m-Hydroxyaniline

: 621-42-1
meta-hydroxyacetanilide

Conditions

Conditions	Yield
In tetrahydrofuran for 1h; Ambient temperature;	100%

: 591-27-5
m-Hydroxyaniline

: C6H6(2)HNO

Conditions

Conditions	Yield
With d(4)-methanol; triethylamine for 336h; Ambient temperature;	100%

: 51640-36-9
2-chloro-1,3-thiazole-5-carbonitrile

: 591-27-5
m-Hydroxyaniline

: 946885-69-4
2-(3-aminophenoxy)-1,3-thiazole-5-carbonitrile

Conditions

Conditions	Yield
With potassium carbonate In N,N-dimethyl-formamide at 20℃;	100%

: 591-27-5
m-Hydroxyaniline

: 13790-39-1
6,7-dimethoxy-4-chloroquinazoline

: 1188908-37-3
3-(6,7-dimethoxyquinazolin-4-yloxy)-benzenamine

Conditions

Conditions	Yield
Stage #1: m-Hydroxyaniline With caesium carbonate In tetrahydrofuran at 20℃; for 0.5h; Stage #2: 6,7-dimethoxy-4-chloroquinazoline In tetrahydrofuran at 50℃; for 24h;	100%
With tetrabutylammomium bromide; sodium hydroxide In butanone for 0.5h; Reflux;	93%
With tetrabutylammomium bromide; sodium hydroxide In water; butanone Reflux;	93%
Stage #1: m-Hydroxyaniline With potassium tert-butylate In N,N-dimethyl-formamide at 20℃; for 1h; Inert atmosphere; Stage #2: 6,7-dimethoxy-4-chloroquinazoline With potassium carbonate In N,N-dimethyl-formamide at 80 - 85℃; for 2h;	77.9%

: 1583284-78-9
4-chloro-6-(methylthio)-1-(prop-2-ynyl)-1H-pyrazolo[3,4-d]pyrimidine

: 591-27-5
m-Hydroxyaniline

: 1583284-89-2
3-(6-(methylthio)-1-(prop-2-ynyl)-1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)phenol

Conditions

Conditions	Yield
In ethanol for 12h; Reflux; Inert atmosphere;	100%

: 1583284-79-0
1-((1-benzyl-1H-1,2,3-triazol-4-yl)methyl)-4-chloro-6-(methylthio)-1H-pyrazolo[3,4-d]pyrimidine

: 591-27-5
m-Hydroxyaniline

: 1583285-03-3
3-(1-((1-benzyl-1H-1,2,3-triazol-4-yl)methyl)-6-(methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)phenol

Conditions

Conditions	Yield
In ethanol for 12h; Reflux; Inert atmosphere;	100%

: 1253889-39-2
3-(3,5-bis(trifluoromethyl)phenylimino)isobenzofuran-1(3H)-one

: 591-27-5
m-Hydroxyaniline

: 1615737-65-9
N1-(3,5-bis(trifluoromethyl)phenyl)-N2-(3-hydroxyphenyl)phthalamide

Conditions

Conditions	Yield
In tetrahydrofuran at 20℃; Inert atmosphere;	100%

: 2-bromo-1-fluoro-4-(methylsulfonyl)benzene

: 591-27-5
m-Hydroxyaniline

: 3-(2-bromo-4-(methylsulfonyl)phenoxy)aniline

Conditions

Conditions	Yield
With caesium carbonate In dimethyl sulfoxide at 120℃; for 1h; Sealed tube;	100%

: 5-(5-(methylsulfonyl)-2-fluorophenyl)-7-methylimidazo[1,5-a]pyrazine-8(7H)-one

: 591-27-5
m-Hydroxyaniline

: 5-(2-(3-aminophenoxy)-5-(methylsulfonyl)phenyl)-7-methylimidazo[1,5-a]pyrazin-8(7H)-one

Conditions

Conditions	Yield
With potassium carbonate In N,N-dimethyl-formamide at 80℃; for 12h;	99.16%

: 541-41-3
chloroformic acid ethyl ester

: 591-27-5
m-Hydroxyaniline

: 7159-96-8
ethyl N-(3-hydroxyphenyl)carbamate

Conditions

Conditions	Yield
In ethyl acetate Heating;	99%
In ethyl acetate for 1h; Reflux;	93%
In ethyl acetate for 0.5h; Reflux;	93%

: 292638-85-8
acrylic acid methyl ester

: 591-27-5
m-Hydroxyaniline

: 59486-18-9
3-[(3-hydroxyphenyl)(2-methoxycarbonylethyl)amino]propionic acid methyl ester

Conditions

Conditions	Yield
With acetic acid at 80℃; for 120h;	99%
With sodium bromide In acetic acid at 95℃; for 19h; Inert atmosphere;	86%
With acetic acid; sodium bromide at 95℃; for 19h; Inert atmosphere;	78.4%
With acetic acid; copper(l) chloride for 20h; Reflux;	65%

: 591-27-5
m-Hydroxyaniline

: 372-20-3
3-fluorophenol

Conditions

Conditions	Yield
With pyridine hydrogenfluoride; sodium nitrite 1.) O deg C, 20 min, 2.) 60 deg C, 1 h;	99%
Stage #1: m-Hydroxyaniline With hydrogen fluoride; sodium nitrite at -10 - -5℃; for 1h; Inert atmosphere; Stage #2: at 48 - 54℃; Concentration; Time; Temperature;	45.6%
With hydrogen fluoride; sodium nitrite at 0℃;

: 2524-04-1
diethyl phosphorochloridothioate

: 591-27-5
m-Hydroxyaniline

: O-phenyl> O,O-diethyl phosphorothioate

Conditions

Conditions	Yield
With triethylamine In chloroform at 60℃; for 3h;	99%

: 122664-30-6
N-acetyl-β-phenylacetoacetamide

: 591-27-5
m-Hydroxyaniline

: 122664-42-0
2,6-dimethyl-5-phenyl-1-(3'-hydroxyphenyl)-4-oxo-1,4-dihydropyrimidine

Conditions

Conditions	Yield
In acetic acid for 1h;	99%
In acetic acid for 1h; Heating;	99%
With acetic acid for 1h; Heating;	60%

: 87-13-8
diethyl 2-ethoxymethylenemalonate

: 591-27-5
m-Hydroxyaniline

: 84165-81-1
1,3-diethyl 2-(((3-hydroxyphenyl)amino)methylidene)propanedioate

Conditions

Conditions	Yield
In ethanol at 20℃; for 0.25h;	99%
With zinc(II) chloride In ethanol Heating;	89%

: 94-75-7
2,4-Dichlorophenoxyacetic acid

: 591-27-5
m-Hydroxyaniline

: 2-(2,4-dichloro-phenoxy)-N-(3-hydroxy-phenyl)-acetamide

Conditions

Conditions	Yield
With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 20℃;	99%
With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine In N,N-dimethyl-formamide at 20℃;	99%

: 86-98-6
4,7-dichloroquinoline

: 591-27-5
m-Hydroxyaniline

: 154179-33-6
4-(3'-hydroxyphenyl)amino-7-chloroquinoline

Conditions

Conditions	Yield
In ethanol Reflux;	99%
for 0.25h; microwave irradiation;	75%
With hydrogenchloride; potassium iodide In ethanol Heating;

: 616-38-6
carbonic acid dimethyl ester

: 591-27-5
m-Hydroxyaniline

: 536-90-3
m-Anisidine

Conditions

Conditions	Yield
With dimanganese decacarbonyl at 180℃; for 1h;	99%

: 135636-66-7
butane-2,3-dione mono-oxime

: 591-27-5
m-Hydroxyaniline

: N-(3-hydroxyphenyl)diacetylmonoxime

Conditions

Conditions	Yield
In ethanol Reflux;	99%
In ethanol Reflux;	99%

3-Aminophenol Specification

3-Aminophenol is an organic compound with the formula C₆H₇NO, and its systematic name is the same with the product name. With the CAS registry number 591-27-5, it is also named as 3-Amino-1-hydroxybenzene. It belongs to the product categories of Aromatic Phenols; Anilines, Aromatic Amines and Nitro Compounds; Organics; Phenoles and thiophenoles; API intermediates; Organic Chemicals; Organic Building Blocks; Oxygen Compounds; Phenols; AM to AQ Chemical Class; Alpha sort; Amines; Aromatics; Pesticides & Metabolites. Its EINECS number is 209-711-2. In addition, the molecular weight is 109.13. Its classification codes are: (1)Mutation data; (2)Reproductive Effect; (3)Skin / Eye Irritant. This product should be sealed and kept in dark place. Moreover, it should be protected from heat and moisture. It is an aromatic amine and aromatic alcohol. It is an isomer of 2-aminophenol and 4-aminophenol. This chemical is used in organic synthesis. It is an intermediate of dyes and p-aminosalicylic acid. It is also used in the production of antioxidants, stabilizer, developers and color film.

Physical properties of 3-Aminophenol are: (1)ACD/LogP: 0.34±0.21; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.32; (4)ACD/LogD (pH 7.4): 0.34; (5)ACD/BCF (pH 5.5): 1.01; (6)ACD/BCF (pH 7.4): 1.06; (7)ACD/KOC (pH 5.5): 34.64; (8)ACD/KOC (pH 7.4): 36.34; (9)#H bond acceptors: 2; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 46.25 Å²; (13)Index of Refraction: 1.637; (14)Molar Refractivity: 32.4±0.3 cm³; (15)Molar Volume: 90.1±3.0 cm³; (16)Polarizability: 12.8±0.5×10^-24cm³; (17)Surface Tension: 57.4±3.0 dyne/cm; (18)Density: 1.2±0.1 g/cm³; (19)Flash Point: 116.4±19.8 °C; (20)Enthalpy of Vaporization: 56.0±3.0 kJ/mol; (21)Boiling Point: 298.566 °C at 760 mmHg; (22)Vapour Pressure: 0.0±0.6 mmHg at 25°C.

Preparation: this chemical can be prepared by 3-nitro-phenol at the ambient temperature. This reaction will need reagent NaBH₄-SbCl₃ and solvent ethanol with the reaction time of 10 min. The yield is about 93%.

3-Aminophenol can be prepared by 3-nitro-phenol at the ambient temperature

Uses of 3-Aminophenol: it can be used to produce 3-Methylamino-phenol at the temperature of 100 °C. This reaction will need reagent potassium carbonate and solvent dimethylformamide with the reaction time of 2 hours. The yield is about 65%.

3-Aminophenol can be used to produce 3-Methylamino-phenol at the temperature of 100 °C

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation and if swallowed. It is toxic to aquatic organisms as it may cause long-term adverse effects in the aquatic environment. After contact with skin, you should wash immediately with plenty of ... (to be specified by the manufacturer). You must avoid releasing it to the environment, and you need to refer to special instructions/safety data sheet.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(cc(c1)O)N
(2)Std. InChI: InChI=1S/C6H7NO/c7-5-2-1-3-6(8)4-5/h1-4,8H,7H2
(3)Std. InChIKey: CWLKGDAVCFYWJK-UHFFFAOYSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
bird - wild	LD50	oral	237mg/kg (237mg/kg)		Archives of Environmental Contamination and Toxicology. Vol. 12, Pg. 355, 1983.
mammal (species unspecified)	LD50	unreported	1245mg/kg (1245mg/kg)		Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 48(9), Pg. 19, 1983.
mouse	LD50	intraperitoneal	150mg/kg (150mg/kg)		National Technical Information Service. Vol. AD691-490,
mouse	LD50	oral	401mg/kg (401mg/kg)	BEHAVIORAL: EXCITEMENT PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES	Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 32(1), Pg. 49, 1988.
mouse	LD50	unreported	225mg/kg (225mg/kg)		Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 50(3), Pg. 4, 1985.
quail	LD50	oral	750mg/kg (750mg/kg)		Archives of Environmental Contamination and Toxicology. Vol. 12, Pg. 355, 1983.
rat	LC50	inhalation	1162mg/m³ (1162mg/m³)	BEHAVIORAL: EXCITEMENT PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES	Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 32(1), Pg. 49, 1988.
rat	LD50	oral	924mg/kg (924mg/kg)	LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES PERIPHERAL NERVE AND SENSATION: SPASTIC PARALYSIS WITH OR WITHOUT SENSORY CHANGE BEHAVIORAL: EXCITEMENT	Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 32(1), Pg. 49, 1988.
rat	LD50	unreported	1125mg/kg (1125mg/kg)		Gigiena i Sanitariya. For English translation, see HYSAAV. Vol. 50(3), Pg. 4, 1985.
rat	LDLo	intraperitoneal	1gm/kg (1000mg/kg)		Archives Internationales de Pharmacodynamie et de Therapie. Vol. 131, Pg. 151, 1961.

Product Name

3-Aminophenol

Synthetic route

3-Aminophenol Specification

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