2-METHYLCYCLOHEXANONE

Details

Stereochemistry	RACEMIC
Molecular Formula	C7H12O
Molecular Weight	112.1696
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1CCCCC1=O

InChI

InChIKey=LFSAPCRASZRSKS-UHFFFAOYSA-N

InChI=1S/C7H12O/c1-6-4-2-3-5-7(6)8/h6H,2-5H2,1H3

HIDE SMILES / InChI

Molecular Formula	C7H12O
Molecular Weight	112.1696
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

PubMed

Title	Date	PubMed
The Suzuki coupling reaction in the stereocontrolled synthesis of 9-cis-retinoic acid and its ring-demethylated analogues.	2001 Dec 14	11735529
Catalytic Meerwein-Pondorf-Verley reduction by simple aluminum complexes.	2001 Jul 26	11463324
Lithium hexamethyldisilazide/triethylamine-mediated ketone enolization: remarkable rate accelerations stemming from a dimer-based mechanism.	2003 Apr 9	12670196
Unfunctionalized, alpha-epimerizable nonracemic ketones and aldehydes can be accessed by crystallization-induced dynamic resolution of imines.	2003 Mar 19	12630864
Ketone enolization by lithium hexamethyldisilazide: structural and rate studies of the accelerating effects of trialkylamines.	2003 Nov 26	14624589
Reaction of ketones with lithium hexamethyldisilazide: competitive enolizations and 1,2-additions.	2004 Mar 17	15012141
High stereoselectivity on low temperature Diels-Alder reactions.	2005 Dec 9	16542029
Regio- and enantioselective Pd-catalyzed allylic alkylation of ketones through allyl enol carbonates.	2005 Mar 9	15740108
Studies of the condensation of sulfones with ketones and aldehydes.	2006 Jan 20	16408963
Lithium hexamethyldisilazide-mediated enolizations: influence of chelating ligands and hydrocarbon cosolvents on the rates and mechanisms.	2007 Oct 3	17850084
Biotransformation of (+/-)-2-methylcyclohexanone by fungi.	2008 Sep	18427929
N-(2,6-Dimethyl-3-oxo-1-thia-4-aza-spiro-[4.5]dec-4-yl)-2-hydr-oxy-2,2-di-phenyl-acetamide.	2008 Sep 13	21201127
1-Methyl-2,4-bis-(2-methoxy-phen-yl)-3-aza-bicyclo-[3.3.1]nonan-9-one.	2009 Nov 18	21578830
New 3H-indole synthesis by Fischer's method. Part I.	2010 Apr 8	20428058
2,4-Bis(4-chloro-phen-yl)-1-methyl-3-aza-bicyclo-[3.3.1]nonan-9-one.	2010 Feb 6	21580316

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 21:16:00 GMT 2023` Edited by `admin` on `Fri Dec 15 21:16:00 GMT 2023`
Record UNII	56E8224ZFJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-METHYLCYCLOHEXANONE

Systematic Name

English

METHYL ANONE

Common Name

English

NSC-524

Code

English

.ALPHA.-METHYLCYCLOHEXANONE

Common Name

English

2-METHYLCYCLOHEXANONE [HSDB]

Common Name

English

CYCLOHEXANONE, 2-METHYL-

Systematic Name

English

(±)-2-METHYLCYCLOHEXANONE

Systematic Name

English

2-METHYL-1-CYCLOHEXANONE

Systematic Name

English

FEMA NO. 3946

Code

English

2-METHYLCYCLOHEXANONE [FHFI]

Common Name

English

Classification Tree Code System Code

JECFA EVALUATION

2-METHYLCYCLOHEXANONE