3-Fluoro-4-methoxybenzyl cyanide

Modify Date: 2024-01-09 19:16:35

3-Fluoro-4-methoxybenzyl cyanide Structure
3-Fluoro-4-methoxybenzyl cyanide structure
Common Name 3-Fluoro-4-methoxybenzyl cyanide
CAS Number 404-90-0 Molecular Weight 165.164
Density 1.1±0.1 g/cm3 Boiling Point 270.6±25.0 °C at 760 mmHg
Molecular Formula C9H8FNO Melting Point 46-48°C
MSDS N/A Flash Point 117.5±23.2 °C

 Names

Name 3-Fluoro-4-Methoxyphenylacetonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 270.6±25.0 °C at 760 mmHg
Melting Point 46-48°C
Molecular Formula C9H8FNO
Molecular Weight 165.164
Flash Point 117.5±23.2 °C
Exact Mass 165.058990
PSA 33.02000
LogP 1.37
Vapour Pressure 0.0±0.6 mmHg at 25°C
Index of Refraction 1.501

 Safety Information

Hazard Codes Xi: Irritant;
Risk Phrases R20/21/22
Safety Phrases S26-S36/37/39
RIDADR 3439
Packaging Group III
Hazard Class 6.1
HS Code 2926909090

 Synthetic Route

~57%

3-Fluoro-4-methoxybenzyl cyanide Structure

3-Fluoro-4-meth...

CAS#:404-90-0

Literature: Hadida Ruah, Sara S.; Grootenhuis, Peter D.J.; Van Goor, Frederick; Zhou, Jinglan; Bear, Brian; Miller, Mark T.; McCartney, Jason; Numa, Mehdi Michel Jamel Patent: US2007/244159 A1, 2007 ; Location in patent: Page/Page column 90-91 ;

~59%

3-Fluoro-4-methoxybenzyl cyanide Structure

3-Fluoro-4-meth...

CAS#:404-90-0

Literature: Vertex Pharmaceuticals Incorported Patent: US2011/98311 A1, 2011 ;

~92%

3-Fluoro-4-methoxybenzyl cyanide Structure

3-Fluoro-4-meth...

CAS#:404-90-0

Literature: Kuchar, Miroslav; Grimova, Jaroslava; Rejholec, Vaclav; Tomkova, Hana; Jelinkova, Magda; Holubek, Jiri Collection of Czechoslovak Chemical Communications, 1990 , vol. 55, # 1 p. 296 - 306

~%

3-Fluoro-4-methoxybenzyl cyanide Structure

3-Fluoro-4-meth...

CAS#:404-90-0

Literature: American Cyanamid Company Patent: US4199595 A1, 1980 ;

~%

3-Fluoro-4-methoxybenzyl cyanide Structure

3-Fluoro-4-meth...

CAS#:404-90-0

Literature: Kuchar, Miroslav; Grimova, Jaroslava; Rejholec, Vaclav; Tomkova, Hana; Jelinkova, Magda; Holubek, Jiri Collection of Czechoslovak Chemical Communications, 1990 , vol. 55, # 1 p. 296 - 306

 Customs

HS Code 2926909090
Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

(3-Fluoro-4-methoxyphenyl)acetonitrile
Benzeneacetonitrile, 3-fluoro-4-methoxy-
NC1R CF DO1
3-Fluoro-4-methoxybenzyl cyanide
2-(3-Fluoro-4-methoxyphenyl)acetonitrile
MFCD00040889
3-Fluoro-4-methoxylphenylacetonitrile
3-Fluoro-4-methoxybenzeneacetonitrile
3-Fluoro-4-methoxyphenylacetonitrile