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3,4-Dimethoxyphenylacetonitrile, 98%
CAS: 93-17-4 | C10H11NO2 | 177.203 g/mol
$45.53 - $363.66
Chemical Identifiers
| CAS | 93-17-4 |
|---|---|
| Molecular Formula | C10H11NO2 |
| Molecular Weight (g/mol) | 177.203 |
| MDL Number | MFCD00001911 |
| InChI Key | ASLSUMISAQDOOB-UHFFFAOYSA-N |
| Synonym | 3,4-dimethoxyphenylacetonitrile, 3,4-dimethoxyphenyl acetonitrile, homoveratronitrile, 3,4-dimethoxybenzyl cyanide, veratryl cyanide, 2-3,4-dimethoxyphenyl acetonitrile, 3,4-dimethoxybenzeneacetonitrile, benzeneacetonitrile, 3,4-dimethoxy, unii-62c8s706sp, 3,4-dimethoxy phenylacetonitrile |
| PubChem CID | 66727 |
| IUPAC Name | 2-(3,4-dimethoxyphenyl)acetonitrile |
| SMILES | COC1=C(C=C(C=C1)CC#N)OC |
| Catalog Number | Mfr. No. | Quantity | Price | Quantity | |||||
|---|---|---|---|---|---|---|---|---|---|
| Catalog Number | Mfr. No. | Quantity | Price | Quantity | |||||
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AAA1200314
|
Thermo Scientific Chemicals
A1200314 |
25 g |
N/A
|
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|
AAA1200322
|
Thermo Scientific Chemicals
A1200322 |
100 g |
N/A
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AAA1200336
|
Thermo Scientific Chemicals
A1200336 |
500 g |
N/A
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Description
It is employed as an intermediate in the preparation of the muscle relaxant papverin. 3,4-Dimethoxyphenyl)acetonitrile has been used in the synthesis of (Z)-3-(benzo[b]thiophen-2-yl)-2-(3,4-dimethoxyphenyl)acrylonitrile1. It has also been used in the preparation of modified diterpene (±) nimbidiol which relies on a sulfenium ion promoted polyene cyclization.
This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.
ApplicationsIt is employed as an intermediate in the preparation of the muscle relaxant papverin. 3,4-Dimethoxyphenyl)acetonitrile has been used in the synthesis of (Z)-3-(benzo[b]thiophen-2-yl)-2-(3,4-dimethoxyphenyl)acrylonitrile1. It has also been used in the preparation of modified diterpene (±) nimbidiol which relies on a sulfenium ion promoted polyene cyclization.
Solubility
Insoluble in water. Soluble in methanol.
Notes
Store in cool place. Keep away from oxidizing agents.
Chemical Identifiers
| 93-17-4 | |
| 177.203 | |
| ASLSUMISAQDOOB-UHFFFAOYSA-N | |
| 66727 | |
| COC1=C(C=C(C=C1)CC#N)OC |
| C10H11NO2 | |
| MFCD00001911 | |
| 3,4-dimethoxyphenylacetonitrile, 3,4-dimethoxyphenyl acetonitrile, homoveratronitrile, 3,4-dimethoxybenzyl cyanide, veratryl cyanide, 2-3,4-dimethoxyphenyl acetonitrile, 3,4-dimethoxybenzeneacetonitrile, benzeneacetonitrile, 3,4-dimethoxy, unii-62c8s706sp, 3,4-dimethoxy phenylacetonitrile | |
| 2-(3,4-dimethoxyphenyl)acetonitrile |
Specifications
| 93-17-4 | |
| 177°C to 178°C (10 mmHg) | |
| C10H11NO2 | |
| 25 g | |
| 3,4-dimethoxyphenylacetonitrile, 3,4-dimethoxyphenyl acetonitrile, homoveratronitrile, 3,4-dimethoxybenzyl cyanide, veratryl cyanide, 2-3,4-dimethoxyphenyl acetonitrile, 3,4-dimethoxybenzeneacetonitrile, benzeneacetonitrile, 3,4-dimethoxy, unii-62c8s706sp, 3,4-dimethoxy phenylacetonitrile | |
| ASLSUMISAQDOOB-UHFFFAOYSA-N | |
| 2-(3,4-dimethoxyphenyl)acetonitrile | |
| 66727 | |
| 98% |
| 62°C to 65°C | |
| Characteristic | |
| MFCD00001911 | |
| 1956100 | |
| Insoluble in water. Soluble in methanol. | |
| COC1=C(C=C(C=C1)CC#N)OC | |
| 177.203 | |
| 177.2 | |
| 3,4-Dimethoxyphenylacetonitrile |
Safety and Handling
GHS H Statement
H302-H312
Harmful if swallowed.
Harmful in contact with skin.
P261-P264b-P270-P271-P280-P301+P310-P302+P352-P304+P340-P311-P312-P330-P361-P363-P501c
H301+H311+H331
DOTInformation : Hazard Class: 6.1; Packaging Group: III
EINECSNumber : 202-225-1
RTECSNumber : AL9325000
TSCA : No
Recommended Storage : Ambient temperatures
RUO – Research Use Only