Bicyclo[4.2.0]octane-7-carbonitrile,7-(1,1-dimethylethyl)-8-oxo-

Modify Date: 2025-08-27 18:27:07

Bicyclo[4.2.0]octane-7-carbonitrile,7-(1,1-dimethylethyl)-8-oxo- structure	Common Name	Bicyclo[4.2.0]octane-7-carbonitrile,7-(1,1-dimethylethyl)-8-oxo-
	CAS Number	57681-20-6	Molecular Weight	205.29600
	Density	1.03g/cm3	Boiling Point	329.5ºC at 760 mmHg
	Molecular Formula	C₁₃H₁₉NO	Melting Point	N/A
	MSDS	N/A	Flash Point	153.1ºC

Name	7-tert-butyl-8-oxobicyclo[4.2.0]octane-7-carbonitrile
Synonym	More Synonyms

Density	1.03g/cm3
Boiling Point	329.5ºC at 760 mmHg
Molecular Formula	C₁₃H₁₉NO
Molecular Weight	205.29600
Flash Point	153.1ºC
Exact Mass	205.14700
PSA	40.86000
LogP	2.93158
Index of Refraction	1.497
InChIKey	HKXYKDXRNHMZDA-UHFFFAOYSA-N
SMILES	CC(C)(C)C1(C#N)C(=O)C2CCCCC21

2,5-Cyclohexadi...

CAS#:29342-21-0

Cyclohexene

CAS#:110-83-8

Bicyclo[4.2.0]o...

CAS#:57681-20-6

Literature: Weyler,W. et al. Journal of the American Chemical Society, 1975 , vol. 97, p. 6187 - 6192

Precursor 2
CAS#:29342-21-0 2,5-Cyclohexadi... CAS#:110-83-8 Cyclohexene
DownStream 0

8-tert-butyl-7-oxobicyclo[4.2.0]octane-8-carbonitrile

7-Cyano-7-t-butyl-bicyclo[4.2.0]octan-8-on

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