(3,4-Dimethoxyphenyl)acetonitrile supplier

Name
(3,4-Dimethoxyphenyl)acetonitrile
EINECS 202-225-1
CAS No. 93-17-4
Article Data50
CAS DataBase
Density 1.082 g/cm³
Solubility insoluble in water
Melting Point 54-57 °C(lit.)
Formula C₁₀H₁₁NO₂
Boiling Point 319.7 °C at 760 mmHg
Molecular Weight 177.203
Flash Point 116.6 °C
Transport Information UN 3276
Appearance white to almost white crystals or cryst. needles
Safety 36/37-45-22-36-26
Risk Codes 22-23/24/25-36/37/38-20/21/22
Molecular Structure
Hazard Symbols Xn, T
Synonyms Acetonitrile,(3,4-dimethoxyphenyl)- (6CI,7CI,8CI);3,4-Dimethoxyphenylacetonitrile;2-(3,4-Dimethoxyphenyl)acetonitrile;3,4-Dimethoxybenzyl cyanide;Homoveratronitrile;NSC 6324;Veratryl cyanide;
PSA 42.25000
LogP 1.76988

Synthetic route

: 5663-56-9
2-(3,4-dimethoxyphenyl)acetamide

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With ethyl phosphodichloridite; 1,8-diazabicyclo[5.4.0]undec-7-ene In dichloromethane at 20℃; for 2h;	92%

: 7306-46-9
4-chloromethyl-1,2-dimethoxy-benzene

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With sodium cyanide	91%

: 84784-38-3
α-(3,4-dimethoxyphenyl)-α-(methylthio)acetonitrile

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With acetic acid; zinc at 100℃; for 1h;	90%

: 77733-60-9
2-(3,4-dimethoxyphenyl)acetaldehyde oxime

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With trimethylsilyl iodide; 1,1,1,3,3,3-hexamethyl-disilazane In chloroform at 56℃; for 4h;	86%
With trimethylsilyl iodide; 1,1,1,3,3,3-hexamethyl-disilazane In chloroform at 56℃; for 4h; Product distribution; other temperature, without hexamethyldisilazane (TMS2NH);	86%
With acetic anhydride
With trimethylsilyl iodide In chloroform for 2h; Ambient temperature;	40 mg

: 928664-98-6
4-isoxazoleboronic acid pinacol ester

: 2859-78-1
4-Bromoveratrole

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; potassium fluoride; water In dimethyl sulfoxide at 130℃; for 16h; Domino Suzuki coupling and fragmentation reaction; Inert atmosphere;	84%

: 145736-65-8
3,4-Dimethoxyphenylthioacetamid

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With 1-oxa-2-azaspiro[2.5]octane In toluene at 20 - 25℃; for 4h;	82%

: 2859-78-1
4-Bromoveratrole

: 75-05-8
acetonitrile

A: 93-17-4
3,4-dimethoxyphenylacetonitrile

B: 7250-04-6
bis(3,4-dimethoxyphenyl)acetonitrile

Conditions

Conditions	Yield
With ethoxyethoxyethanol; sodium amide In 1,2-dimethoxyethane 1.) 45 deg C, 2 h, 2.) -10 deg C, 2 h, 3.) -45 deg C, 4.5 h;	A 78% B 8%

...Expand

: 143-33-9
sodium cyanide

: 76950-82-8
1-(3,4-Dimethoxy-benzyl)-2-methylsulfanyl-4,6-diphenyl-pyridinium; iodide

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
In 1,2-dimethoxyethane for 24h; Heating;	76%

: 151-50-8
potassium cyanide

: 7306-46-9
4-chloromethyl-1,2-dimethoxy-benzene

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
In dimethyl sulfoxide for 20h;	67%
With benzene
With hydrogenchloride

: 120-20-7
2-(3,4-dimethoxyphenyl)-ethylamine

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With iodine; 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione In dimethyl sulfoxide at 65℃; for 3h;	64%

: 51655-39-1
2-bromo-4,5-dimethoxyphenylacetonitrile

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
Stage #1: 2-bromo-4,5-dimethoxyphenylacetonitrile With nickel(II) iodide; 1,4-bis(dicyclohexylphosphino)butane; sodium carbonate; cesium iodide In tetrahydrofuran for 0.25h; Schlenk technique; Glovebox; Stage #2: In tetrahydrofuran at 35℃; for 72h; Irradiation;	54%

: 93-40-3
(3,4-Dimethoxyphenyl)acetic acid

: 22821-76-7
4-(methylsulfonyl)benzonitrile

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With riboflavin-2',3',4',5'-tetra-acetate In acetonitrile at 25℃; for 12h; Inert atmosphere; Irradiation; Sealed tube;	45%

: 2460-33-5
3,4-dimethoxyphenylpyruvic acid

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With acetic anhydride

: 77733-60-9
2-(3,4-dimethoxyphenyl)acetaldehyde oxime

: 108-24-7
acetic anhydride

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 6443-67-0
3,4-dimethoxy-α-ethoxycarbonyloxybenzyl cyanide

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With p-menth-1-ene; palladium on activated charcoal

: 143-33-9
sodium cyanide

: 93-03-8
(3,4-dimethoxyphenyl)methanol

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
(i) aq. HCl, CH2Cl2, (ii) /BRN= 3587243/, KI, acetone; Multistep reaction;
(i) aq. HCl, (ii) /BRN= 3587243/, DMSO; Multistep reaction;

: 21852-32-4
4-bromomethyl-1,2-dimethoxybenzene

: 143-33-9
sodium cyanide

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
In ethanol; water for 5h; Heating;

: 36848-69-8
ethyl 2-cyano-2-(3,4-dimethoxyphenyl)acetate

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With sodium hydroxide In water at 80 - 90℃; for 2h; Yield given;

: 96824-26-9
Phosphoric acid cyano-(3,4-dimethoxy-phenyl)-methyl ester diethyl ester

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With hydrogen; palladium on activated charcoal In ethyl acetate for 2h; Ambient temperature; Yield given;

: 4468-58-0
3-hydroxy-4-methoxyphenylacetonitrile

: 77-78-1
dimethyl sulfate

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With sodium hydroxide at 0℃; for 1h;

: 143-33-9
sodium cyanide

: 7306-46-9
4-chloromethyl-1,2-dimethoxy-benzene

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
In 1,4-dioxane; water
In water; benzene for 6h; Heating; Yield given;

: 143-33-9
sodium cyanide

: 7306-46-9
4-chloromethyl-1,2-dimethoxy-benzene

A: 93-17-4
3,4-dimethoxyphenylacetonitrile

B: 18656-85-4
(Z)-1,2-dicyano-1,2-bis(3,4-dimethoxyphenyl)ethene

Conditions

Conditions	Yield
In tetrachloromethane; water Heating;

...Expand

(+-)-benzoyloxy-<3.4-dimethoxy-phenyl>-acetonitrile: (+-)-benzoyloxy-<3.4-dimethoxy-phenyl>-acetonitrile

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With p-menth-1-ene; palladium
With tetralin; palladium

3.4-dimethoxy-phenylpyruvic acid-oxime: 3.4-dimethoxy-phenylpyruvic acid-oxime

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
at 155℃;

ethoxycarbonyloxy-<3,4-dimethoxy-phenyl>-acetonitrile: ethoxycarbonyloxy-<3,4-dimethoxy-phenyl>-acetonitrile

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With palladium; benzene Hydrogenation;

oxime of homoveratraldehyde: oxime of homoveratraldehyde

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With acetic anhydride

: 119-64-2
tetralin

: 102327-45-7
2-benzoyloxy-2-(3',4'-dimethoxyphenyl)-acetonitrile

palladium: palladium

: 93-17-4
3,4-dimethoxyphenylacetonitrile

...Expand

: 102327-45-7
2-benzoyloxy-2-(3',4'-dimethoxyphenyl)-acetonitrile

(R)-p-menthene-(1): (R)-p-menthene-(1)

palladium: palladium

: 93-17-4
3,4-dimethoxyphenylacetonitrile

...Expand

: 21852-32-4
4-bromomethyl-1,2-dimethoxybenzene

: 151-50-8
potassium cyanide

: 93-17-4
3,4-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
In ethanol; water for 4h; Substitution; Heating;

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 120-20-7
2-(3,4-dimethoxyphenyl)-ethylamine

Conditions

Conditions	Yield
With hydrogen; palladium on activated charcoal In acetic acid for 4h;	100%
Stage #1: 3,4-dimethoxyphenylacetonitrile With diborane In tetrahydrofuran at 55℃; for 16h; Inert atmosphere; Stage #2: With hydrogenchloride; water In tetrahydrofuran at 0 - 20℃; Stage #3: With sodium hydroxide In tetrahydrofuran; water	99%
With hydrogen; nickel In ethanol at 40℃; electrocatalytic hydrogenation;	98%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 635-85-8
homoveratrylamine hydrochloride

Conditions

Conditions	Yield
With hydrogenchloride; hydrogen In propan-1-ol; water at 60℃; under 375.038 Torr; for 18h; Flow reactor;	100%
Stage #1: 3,4-dimethoxyphenylacetonitrile With borane-ammonia complex; C17H16BrMnN2O3S In hexane at 60℃; for 12h; Stage #2: With hydrogenchloride In diethyl ether; water	90%

: 916322-38-8
1-η**(5)-ferrocenyl-3,3-bis(methylthio)prop-2-en-1-one

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: C24H23FeNO3S

Conditions

Conditions	Yield
Stage #1: 3,4-dimethoxyphenylacetonitrile With sodium hydride In N,N-dimethyl-formamide; mineral oil; benzene at 0℃; for 0.25h; Stage #2: 3,3-bis(methylsulfanyl)-1-η5-ferrocenyl-2-propen-1-one In N,N-dimethyl-formamide; mineral oil; benzene at 0 - 20℃;	100%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 123-11-5
4-methoxy-benzaldehyde

: 37629-77-9
(Z)-2-(3,4-dimethoxyphenyl)-3-(4-methoxyphenyl)acrylonitrile

Conditions

Conditions	Yield
With sodium ethanolate In ethanol Reflux; Inert atmosphere;	99%
With sodium methylate In ethanol at 20℃; for 3h;	92%
With sodium ethanolate In ethanol at 85℃; for 1h; Knoevenagel Condensation; Inert atmosphere;	90%

: 64-17-5
ethanol

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 81316-62-3
ethyl 2-(3,4-dimethoxyphenyl)acetoimidate hydrochloride

Conditions

Conditions	Yield
With hydrogenchloride at 0 - 5℃; Addition;	99%
With hydrogenchloride	88%
With hydrogenchloride In chloroform for 2h; Ambient temperature;
With hydrogenchloride In diethyl ether

: 93-17-4
3,4-dimethoxyphenylacetonitrile

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

: 37629-72-4
(Z)-α-(3,4-dimethoxyphenyl)-3,4-dimethoxycinnamonitrile

Conditions

Conditions	Yield
With sodium ethanolate In ethanol at 85℃; for 1h;	98%
With sodium ethanolate In ethanol for 1h; Reflux; Inert atmosphere;	97%
With sodium ethanolate In ethanol at 85℃; for 1h; Knoevenagel Condensation; Inert atmosphere;	97%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 4637-24-5
N,N-dimethyl-formamide dimethyl acetal

: Z-2-(3,4-dimethoxyphenyl)-3-dimethylaminoacrylonitrile

Conditions

Conditions	Yield
In N,N-dimethyl-formamide for 4h; Reflux;	98%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 2-(3,4-dimethoxyphenyl)ethan-1,1-d2-1-amine hydrochloride

Conditions

Conditions	Yield
Stage #1: 3,4-dimethoxyphenylacetonitrile With samarium diiodide; water-d2; triethylamine In tetrahydrofuran at 20℃; for 0.25h; Inert atmosphere; Stage #2: With hydrogenchloride In water regioselective reaction;	98%
Stage #1: 3,4-dimethoxyphenylacetonitrile With samarium diiodide; water-d2; triethylamine In tetrahydrofuran at 20℃; for 0.25h; Inert atmosphere; Stage #2: With hydrogenchloride	98%
Stage #1: 3,4-dimethoxyphenylacetonitrile With ethyl [2]alcohol; sodium In hexane; mineral oil at 0℃; for 0.166667h; Inert atmosphere; Stage #2: With hydrogenchloride In diethyl ether	92%

: 154786-34-2
4-[(6-hydroxyhexyl)oxy]-3,5-dimethoxybenzaldehyde

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 1425539-63-4
(2Z)-2-(3,4-dimethoxyphenyl)-3-{4-[(6-hydroxyhexyl)oxy]-3,5-dimethoxyphenyl}prop-2-enenitrile

Conditions

Conditions	Yield
	97%

: 363-72-4
Pentafluorobenzene

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: α-(3',4'-Dimethoxyphenyl)-2,3,5,6-tetrafluorophenylacetonitrile

Conditions

Conditions	Yield
With lithium tert-butoxide In N,N-dimethyl-formamide at 20℃; for 0.5h; Inert atmosphere; regioselective reaction;	97%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 111-27-3
hexan-1-ol

: 93148-41-5
α-<3.4-Dimethoxy-phenyl>-caprylsaeurenitril

Conditions

Conditions	Yield
With [carbonylchlorohydrido{bis[2-(diphenylphosphinomethyl)ethyl]amino}ethylamino] ruthenium(II); potassium tert-butylate In toluene at 135℃; for 4h; Inert atmosphere;	97%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 85753-64-6
O,N-bisbenzenesulfonyl-N-methylethanolamine

: 85753-65-7
N-[3-Cyano-3-(3,4-dimethoxy-phenyl)-propyl]-N-methyl-benzenesulfonamide

Conditions

Conditions	Yield
With n-butyllithium In tetrahydrofuran for 1.5h; -78 deg C -> 25 deg C;	96%
With n-butyllithium 1.) THF, -25 deg C; Yield given. Multistep reaction;

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 58432-84-1
2-(2-iodo-4,5-dimethoxyphenyl)acetonitrile

Conditions

Conditions	Yield
With iodine; silver trifluoroacetate In dichloromethane at -10 - -5℃;	96%
With iodine; silver trifluoroacetate In dichloromethane at -5℃; for 0.1h;	93%
With Iodine monochloride; acetic acid at 20℃;	72%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 68-12-2, 33513-42-7
N,N-dimethyl-formamide

: 3,4-dimethoxy-N,N-dimethylbenzothioamide

Conditions

Conditions	Yield
With sulfur; copper acetylacetonate; potassium carbonate at 110℃; for 24h; Schlenk technique;	96%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 1425539-56-5
3-ethoxy-4-[(6-hydroxyhexyl)oxy]benzaldehyde

: 1425539-57-6
(2Z)-2-(3,4-dimethoxyphenyl)-3-{3-ethoxy-4-[(6-hydroxyhexyl)oxy]phenyl}prop-2-enenitrile

Conditions

Conditions	Yield
	96%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 124-40-3
dimethyl amine

: 2-(3,4-dimethoxyphenyl)-N,N-dimethylacetamidine

Conditions

Conditions	Yield
With copper(l) chloride In ethanol; water at 20 - 70℃; for 24h; Inert atmosphere;	96%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 105-58-8
Diethyl carbonate

: 36848-69-8
ethyl 2-cyano-2-(3,4-dimethoxyphenyl)acetate

Conditions

Conditions	Yield
Stage #1: With ethanol; sodium In toluene at 80 - 85℃; for 2h; Stage #2: 3,4-dimethoxyphenylacetonitrile; Diethyl carbonate In toluene at 80℃; for 2h;	95.6%
With sodium at 110℃; for 1h;	80%
Stage #1: 3,4-dimethoxyphenylacetonitrile With sodium In ethanol; toluene Stage #2: Diethyl carbonate at 80℃;

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 51655-39-1
2-bromo-4,5-dimethoxyphenylacetonitrile

Conditions

Conditions	Yield
With N-Bromosuccinimide; trifluoroacetic acid In acetonitrile at 20℃; for 6h;	95%
With bromine; sodium acetate; acetic acid
With N-Bromosuccinimide; trifluoroacetic acid In acetonitrile at 20℃; for 16h;	15.3 g

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 108-94-1
cyclohexanone

: 1-[cyano-(3,4-dimethoxyphenyl)-methyl]cyclohexanol

Conditions

Conditions	Yield
With sodium hydroxide; tetra(n-butyl)ammonium hydrogensulfate at 0 - 15℃; for 1h;	95%
With sodium hydroxide; benzyltrimethylammonium chloride In water at 0 - 15℃;	71%

: 7521-41-7
2-Aminonicotinaldehyde

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 1075240-57-1
3-(3,4-dimethoxyphenyl)-[1,8]naphthyridin-2-ylamine

Conditions

Conditions	Yield
With aminosulfonic acid for 0.05h; microwave irradiation;	95%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 86-81-7
3,4,5-trimethoxy-benzaldehyde

: (Z)-3-(3,4,5-trimethoxyphenyl)-2-(3,4-dimethoxyphenyl)acrylonitrile

Conditions

Conditions	Yield
With sodium ethanolate In ethanol at 85℃; for 1h; Knoevenagel Condensation; Inert atmosphere;	95%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 5-(3',4'-dimethoxybenzyl)-1H-tetrazole

Conditions

Conditions	Yield
With sodium azide; ammonium chloride In N,N-dimethyl-formamide for 24h; Reflux;	95%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: C10H9(2)H2NO2

Conditions

Conditions	Yield
With water-d2; triethylamine at 20℃; for 24h; Inert atmosphere;	95%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 5663-56-9
2-(3,4-dimethoxyphenyl)acetamide

Conditions

Conditions	Yield
With potassium hydroxide In tert-butyl alcohol for 1h; Reagent/catalyst; Solvent; Reflux;	94%
With hydrogenchloride
Multi-step reaction with 3 steps 1: aq.-ethanolic KOH-solution 2: hydrogen chloride 3: aqueous ammonia View Scheme
With Rhodococcus rhodochrous ATCC BAA 870 cobalt nitrile hydratase In aq. buffer at 30℃; pH=7.6; Enzymatic reaction;

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 104-88-1
4-chlorobenzaldehyde

: 37629-70-2
(Z)-3-(4-chlorophenyl)-2-(3,4-dimethoxyphenyl)acrylonitrile

Conditions

Conditions	Yield
With sodium methylate In ethanol at 20℃; for 2h;	94%
With ethanol; sodium ethanolate

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 100-52-7
benzaldehyde

: 2958-55-6
(Z)-2-(3,4-dimethoxyphenyl)-3-phenylacrylonitrile

Conditions

Conditions	Yield
With sodium methylate In ethanol at 20℃; for 2h;	94%
With sodium ethanolate In ethanol at 85℃; for 1h; Knoevenagel condensation; Inert atmosphere;	77%
With ethanol; sodium ethanolate
With sodium ethanolate In ethanol Heating;

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 16714-25-3
2-azidobenzaldehyde

: 4-(3,4-Dimethoxy-phenyl)-1,2,3,9b-tetraaza-cyclopenta[a]naphthalene

Conditions

Conditions	Yield
With sodium ethanolate In ethanol; acetonitrile for 12h; Ambient temperature;	94%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 74-88-4
methyl iodide

: 23023-16-7
2‐(3,4‐dimethoxyphenyl)‐2‐methylpropionitrile

Conditions

Conditions	Yield
Stage #1: 3,4-dimethoxyphenylacetonitrile With sodium hydride In tetrahydrofuran at 0℃; for 0.5h; Stage #2: methyl iodide In tetrahydrofuran for 12h; Product distribution / selectivity;	94%
Stage #1: 3,4-dimethoxyphenylacetonitrile With sodium hydride In tetrahydrofuran at 0℃; for 0.5h; Inert atmosphere; Stage #2: methyl iodide In tetrahydrofuran at 0 - 20℃; for 3h; Inert atmosphere;	93%
Stage #1: 3,4-dimethoxyphenylacetonitrile With sodium hydride In tetrahydrofuran at 0℃; for 0.5h; Inert atmosphere; Stage #2: methyl iodide In tetrahydrofuran at 0 - 20℃; for 2.5h; Inert atmosphere;	93%

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 2103-57-3
2,3,4-trimethoxybenzaldehyde

: 1151666-74-8
(Z)-3-(2,3,4-trimethoxyphenyl)-2-(3,4-dimethoxyphenyl)acrylonitrile

Conditions

Conditions	Yield
With sodium ethanolate In ethanol at 85℃; for 1h; Knoevenagel Condensation; Inert atmosphere;	94%
With sodium ethanolate In ethanol at 85℃; for 1h; Knoevenagel Condensation; Inert atmosphere;	94%

: 2466-76-4
N-Acetylimidazole

: 93-17-4
3,4-dimethoxyphenylacetonitrile

: 18133-46-5, 63895-79-4
α-(3,4-dimethoxyphenyl)acetoacetonitrile

Conditions

Conditions	Yield
With lithium hydride In dimethyl sulfoxide at 20℃; for 0.5h;	94%

(3,4-Dimethoxyphenyl)acetonitrile Chemical Properties

IUPAC Name: 2-(3,4-Dimethoxyphenyl)acetonitrile
Synonyms of 3,4-Dimethoxyphenylacetonitrile (CAS NO.93-17-4): 3,4-Dimethoxybenzyl cyanide ; 3,4-Dimethoxyphenylacetonitrile ; 3,4-Dimethylbenzyl cyanide ; 4-10-00-01513 (Beilstein Handbook Reference) ; AI3-23882 ; Acetonitrile, 3,4-(dimethoxyphenyl)- ; BRN 1956100 ; EINECS 202-225-1 ; Homoveratronitrile ; NSC 6324 ; Veratryl cyanide ; Benzeneacetonitrile, 3,4-dimethoxy- (9CI)
CAS NO: 93-17-4
Molecular Formula: C₁₀H₁₁NO₂
Molecular Weight: 177.1998
Molecular Structure:

Melting Point: 54-57 °C
ProductCategories: Catechol Derivatives ; Aromatic Nitriles ; Nitriles
Polar Surface Area: 42.25 Å²
Index of Refraction: 1.511
Molar Refractivity: 49.07 cm³
Molar Volume: 163.6 cm³
Surface Tension: 37.7 dyne/cm
Density of 3,4-Dimethoxyphenylacetonitrile (CAS NO.93-17-4): 1.082 g/cm³
Flash Point: 116.6 °C
Enthalpy of Vaporization: 56.13 kJ/mol
Boiling Point: 319.7 °C at 760 mmHg
Vapour Pressure: 0.000333 mmHg at 25°C

(3,4-Dimethoxyphenyl)acetonitrile Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intravenous	178mg/kg (178mg/kg)		U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00302,
mouse	LD50	oral	1029mg/kg (1029mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: ANALGESIA	Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 26(2), Pg. 55, 1982.
rat	LD50	unreported	1500mg/kg (1500mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: ANALGESIA	Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 26(2), Pg. 55, 1982.

(3,4-Dimethoxyphenyl)acetonitrile Consensus Reports

Cyanide and its compounds are on the Community Right-To-Know List.

(3,4-Dimethoxyphenyl)acetonitrile Safety Profile

Hazard Codes of 3,4-Dimethoxyphenylacetonitrile (CAS NO.93-17-4): Harmful Xn, Toxic T
Risk Statements: 23/24/25-36/37/38-20/21/22
R23/24/25: Toxic by inhalation, in contact with skin and if swallowed.
R36/37/38: Irritating to eyes, respiratory system and skin.
R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.
Safety Statements: 36/37-45-22-26
S36/37: Wear suitable protective clothing and gloves.
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
S22: Do not breathe dust.
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
RIDADR: 3276
WGK Germany: 3
RTECS: AL9325000
Hazard Note: Irritant
Poison by intravenous route. Moderately toxic by ingestion. When heated to decomposition it emits toxic fumes of NO_x and CN⁻. See also NITRILES.

Product Name

(3,4-Dimethoxyphenyl)acetonitrile

Synthetic route

(3,4-Dimethoxyphenyl)acetonitrile Chemical Properties

(3,4-Dimethoxyphenyl)acetonitrile Toxicity Data With Reference

(3,4-Dimethoxyphenyl)acetonitrile Consensus Reports

(3,4-Dimethoxyphenyl)acetonitrile Safety Profile

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