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Details

Stereochemistry ACHIRAL
Molecular Formula C7H12O
Molecular Weight 112.1696
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-METHYLCYCLOHEXANONE

SMILES

CC1CCC(=O)CC1

InChI

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

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
A concise total synthesis of (+/-)-acutifolone A.
2009-08-21
rac-2-Hydroxy-2,8-dimethyl-4-morpho-linoethyl-1-thia-4-aza-spiro-[4.5]decan-3-one.
2008-07-23
8-Methyl-4-morpholinoethyl-1-thia-4-aza-spiro-[4.5]decan-3-one.
2008-07-23
Enolate structure and electron affinity.
2005-10-06
Catalytic oxidation with air of cyclohexanone to dicarboxylic acids on synthetic carbons. Effect of supported metals and solvents.
2005-02-17
A concise formal synthesis of alkaloid cryptotackiene and substituted 6H-indolo[2,3-b]quinolines.
2004-08-20
Patents
Name Type Language
4-METHYLCYCLOHEXANONE
FHFI  
Systematic Name English
FEMA NO. 3948
Preferred Name English
METHYLCYCLOHEXANONE
Systematic Name English
4-METHYLCYCLOHEXANONE [FHFI]
Common Name English
4-METHYL-1-CYCLOHEXANONE
Systematic Name English
NSC-3816
Code English
CYCLOHEXANONE, 4-METHYL-
Systematic Name English
Classification Tree Code System Code
JECFA EVALUATION 4-METHYLCYCLOHEXANONE
Created by admin on Mon Mar 31 19:02:24 GMT 2025 , Edited by admin on Mon Mar 31 19:02:24 GMT 2025
Code System Code Type Description
NSC
3816
Created by admin on Mon Mar 31 19:02:24 GMT 2025 , Edited by admin on Mon Mar 31 19:02:24 GMT 2025
PRIMARY
CAS
1331-22-2
Created by admin on Mon Mar 31 19:02:24 GMT 2025 , Edited by admin on Mon Mar 31 19:02:24 GMT 2025
NON-SPECIFIC SUBSTITUTION
FDA UNII
0L1R78K79S
Created by admin on Mon Mar 31 19:02:24 GMT 2025 , Edited by admin on Mon Mar 31 19:02:24 GMT 2025
PRIMARY
CAS
589-92-4
Created by admin on Mon Mar 31 19:02:24 GMT 2025 , Edited by admin on Mon Mar 31 19:02:24 GMT 2025
PRIMARY
PUBCHEM
11525
Created by admin on Mon Mar 31 19:02:24 GMT 2025 , Edited by admin on Mon Mar 31 19:02:24 GMT 2025
PRIMARY
EPA CompTox
DTXSID5060435
Created by admin on Mon Mar 31 19:02:24 GMT 2025 , Edited by admin on Mon Mar 31 19:02:24 GMT 2025
PRIMARY
JECFA MONOGRAPH
1036
Created by admin on Mon Mar 31 19:02:24 GMT 2025 , Edited by admin on Mon Mar 31 19:02:24 GMT 2025
PRIMARY
ECHA (EC/EINECS)
209-665-3
Created by admin on Mon Mar 31 19:02:24 GMT 2025 , Edited by admin on Mon Mar 31 19:02:24 GMT 2025
PRIMARY