2-tert-butyl-4-methylcyclohexan-1-one

Modify Date: 2025-10-18 16:34:08

2-tert-butyl-4-methylcyclohexan-1-one structure	Common Name	2-tert-butyl-4-methylcyclohexan-1-one
	CAS Number	71436-86-7	Molecular Weight	168.27600
	Density	0.889g/cm3	Boiling Point	226.4ºC at 760 mmHg
	Molecular Formula	C₁₁H₂₀O	Melting Point	N/A
	MSDS	N/A	Flash Point	83.5ºC

Name	2-tert-butyl-4-methylcyclohexan-1-one
Synonym	More Synonyms

Density	0.889g/cm3
Boiling Point	226.4ºC at 760 mmHg
Molecular Formula	C₁₁H₂₀O
Molecular Weight	168.27600
Flash Point	83.5ºC
Exact Mass	168.15100
PSA	17.07000
LogP	3.03780
Index of Refraction	1.448
InChIKey	JYQXSLRPPWZDEB-UHFFFAOYSA-N
SMILES	CC1CCC(=O)C(C(C)(C)C)C1

tert-butyl chloride

CAS#:507-20-0

trimethyl-(4-me...

CAS#:38671-78-2

~56%

2-tert-butyl-4-...

CAS#:71436-86-7

Literature: Sasidharan, Manickam; Bhaumik, Asim Journal of Molecular Catalysis A: Chemical, 2011 , vol. 346, # 1-2 p. 87 - 93

patchouli cyclo...

CAS#:67634-11-1

2-tert-butyl-4-...

CAS#:71436-86-7

Literature: Ungnade; McLaren Journal of Organic Chemistry, 1945 , vol. 10, p. 29,30

Precursor 3
CAS#:507-20-0 tert-butyl chloride CAS#:38671-78-2 trimethyl-(4-me... CAS#:67634-11-1 patchouli cyclo...
DownStream 0

Cyclohexanone,2-(1,1-dimethylethyl)-4-methyl

Cyclohexanone,2-tert-butyl-4-methyl-(7CI)

2-tert-butyl-4-methyl-cyclohexanone

EINECS 275-445-9

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Names