CAS 4594-78-9|2-Oxocyclohexanepropiononitrile

Introduction：Basic information about CAS 4594-78-9|2-Oxocyclohexanepropiononitrile, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Safety Information
4. Customs
5. Articles2
6. Synonyms

Common Name	2-Oxocyclohexanepropiononitrile
CAS Number	4594-78-9	Molecular Weight	151.20600
Density	1.024 g/mL at 20 °C(lit.)	Boiling Point	138-142 °C (10 mmHg)
Molecular Formula	C₉H₁₃NO	Melting Point	/
MSDS	ChineseUSA	Flash Point	135.6ºC
Symbol	GHS07	Signal Word	Warning

Names

Name	2-(beta-cyanoethyl)cyclohexanone
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.024 g/mL at 20 °C(lit.)
Boiling Point	138-142 °C (10 mmHg)
Molecular Formula	C₉H₁₃NO
Molecular Weight	151.20600
Flash Point	135.6ºC
Exact Mass	151.10000
PSA	40.86000
LogP	2.04948
Index of Refraction	n20/D 1.474
InChIKey	SPTVCXKSSRBTMN-UHFFFAOYSA-N
SMILES	N#CCCC1CCCCC1=O

Safety Information

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H302-H312-H332
Precautionary Statements	P280
Personal Protective Equipment	Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes	Xn:Harmful;
Risk Phrases	R20/21
Safety Phrases	S36
RIDADR	UN3276
WGK Germany	3
Packaging Group	III
Hazard Class	6.1
HS Code	2926909090

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%

Articles2

Katritzky AR and Talyor RJK

Comprehensive Organic Functional Group Transformations II , (2004), 2986

Purich DL

Enzyme Kinetics and Mechanism, Part F , (2002) 354 , 109

Synonyms

EINECS 224-991-6

2-Oxocyclohexane-2-propionitrile,3-(2-Oxocyclohexyl)propionitrile

2-Oxo-1-cyclohexanepropionitrile

3-(2-Oxocyclohexyl)propanenitrile

2-Oxocyclohexanepropionitrile

MFCD00013797

2-(2-Cyanoethyl)cyclohexanone

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