(3,4-Dimethoxyphenyl)acetonitrile

ALDRICH/126349 - 98%

Synonym: Homoveratronitrile; (3,4-Dimethoxyphenyl)acetonitrile; 3,4-Dimethoxybenzylcyanide

CAS Number: 93-17-4
Empirical Formula (Hill Notation): C₁₀H₁₁NO₂
Molecular Weight: 177.20
EC Number: 202-225-1
MDL Number: MFCD00001911
Linear Formula: (CH₃O)₂C₆H₃CH₂CN
Product Type: Chemical

Catalog Number	PKG Qty.	Price


45-126349-100G	100 g	$107.00 1/EAAdd To Favorites	Add To Favorites

assay	98%
bp	171-178 °C/10 mmHg (lit.)
fluorescence	λ_ex 430 nm; λ_em 511 nm (pH 7.1)
form	solid
functional group	nitrile
InChI	1S/C10H11NO2/c1-12-9-4-3-8(5-6-11)7-10(9)13-2/h3-4,7H,5H2,1-2H3
InChI key	ASLSUMISAQDOOB-UHFFFAOYSA-N
mp	62-63.5 °C (lit.)
Quality Level	100
SMILES string	COc1ccc(CC#N)cc1OC

Application:	(3,4-Dimethoxyphenyl)acetonitrile has been used in the synthesis of (Z)-3-(benzo[b]thiophen-2-yl)-2-(3,4-dimethoxyphenyl)acrylonitrile. It has also been used in the preparation of modified diterpene (±) nimbidiol which relies on a sulfenium ion promoted polyene cyclization.
Packaging:	100, 500 g in glass bottle

Symbol	GHS07
Signal word	Warning
Hazard statements	H302
Hazard Codes	Xn
Risk Statements	22
Safety Statements	36/37
RIDADR	NONH for all modes of transport
WGK Germany	WGK 3
Flash Point(F)	482.0 °F - closed cup
Flash Point(C)	250 °C - closed cup

Purity	98%
bp	171-178 °C/10 mmHg (lit.)
mp	62-63.5 °C (lit.)
UNSPSC	12352100