p-Nitro-α-tolunitrile

Modify Date: 2025-08-21 19:56:39

p-Nitro-α-tolunitrile Structure
p-Nitro-α-tolunitrile structure
Common Name p-Nitro-α-tolunitrile
CAS Number 89001-53-6 Molecular Weight 162.145
Density 1.3±0.1 g/cm3 Boiling Point 329.6±30.0 °C at 760 mmHg
Molecular Formula C8H6N2O2 Melting Point 100-103ºC(lit.)
MSDS Chinese USA Flash Point 153.1±24.6 °C
Symbol GHS07
GHS07
Signal Word Warning

 Names

Name 2-Methyl-4-nitrobenzonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 329.6±30.0 °C at 760 mmHg
Melting Point 100-103ºC(lit.)
Molecular Formula C8H6N2O2
Molecular Weight 162.145
Flash Point 153.1±24.6 °C
Exact Mass 162.042923
PSA 69.61000
LogP 1.65
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.568

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305 + P351 + P338
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xi: Irritant;
Risk Phrases R36/37/38
Safety Phrases 26-36
RIDADR NONH for all modes of transport
HS Code 2926909090

 Synthetic Route

~93%

p-Nitro-α-tolunitrile Structure

p-Nitro-α-tolun...

CAS#:89001-53-6

Literature: WARNER-LAMBERT COMPANY LLC Patent: WO2004/69245 A1, 2004 ; Location in patent: Page/Page column 109-110 ;

~80%

p-Nitro-α-tolunitrile Structure

p-Nitro-α-tolun...

CAS#:89001-53-6

Literature: GRÜNENTHAL GMBH; FRANK, Robert; BAHRENBERG, Gregor; CHRISTOPH, Thomas; LESCH, Bernhard; LEE, Jeewoo Patent: WO2013/45451 A1, 2013 ; Location in patent: Page/Page column 80 ;

~80%

p-Nitro-α-tolunitrile Structure

p-Nitro-α-tolun...

CAS#:89001-53-6

Literature: GRÜNENTHAL GMBH; FRANK, Robert; BAHRENBERG, Gregor; CHRISTOPH, Thomas; LESCH, Bernhard; LEE, Jeewoo Patent: WO2013/45447 A1, 2013 ; Location in patent: Page/Page column 67 ;

~83%

p-Nitro-α-tolunitrile Structure

p-Nitro-α-tolun...

CAS#:89001-53-6

Literature: Rosowsky, Andre; Forsch, Ronald A.; Null, Allison; Moran, Richard G. Journal of Medicinal Chemistry, 1999 , vol. 42, # 18 p. 3510 - 3519

~%

p-Nitro-α-tolunitrile Structure

p-Nitro-α-tolun...

CAS#:89001-53-6

Literature: US2013/79377 A1, ;

 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

Benzonitrile, 2-methyl-4-nitro-
2-cyano-5-nitrotoluene
2-methyl-4-nitro-benzonitrile
p-Nitro-α-tolunitrile
4-Cyano-3-methylnitrobenzene
4-Nitro-o-tolunitrile
2-Methyl-4-nitrobenzonitrile
2-methyl-4-nitrobenzenecarbonitrile
MFCD03095378
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