U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C8H14O
Molecular Weight 126.1962
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Methylcycloheptanone

SMILES

CC1CCCC(=O)CC1

InChI

InChIKey=WXVNSHRGPVHBPD-UHFFFAOYSA-N
InChI=1S/C8H14O/c1-7-3-2-4-8(9)6-5-7/h7H,2-6H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
4-Methylcycloheptanone
Systematic Name English
NSC-18963
Code English
4-Methylcycloheptan-1-one
Systematic Name English
Cycloheptanone, 4-methyl-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30280873
Created by admin on Sat Dec 16 19:27:24 GMT 2023 , Edited by admin on Sat Dec 16 19:27:24 GMT 2023
PRIMARY
NSC
18963
Created by admin on Sat Dec 16 19:27:24 GMT 2023 , Edited by admin on Sat Dec 16 19:27:24 GMT 2023
PRIMARY
CAS
5452-36-8
Created by admin on Sat Dec 16 19:27:24 GMT 2023 , Edited by admin on Sat Dec 16 19:27:24 GMT 2023
PRIMARY
FDA UNII
ZV82F64ZD5
Created by admin on Sat Dec 16 19:27:24 GMT 2023 , Edited by admin on Sat Dec 16 19:27:24 GMT 2023
PRIMARY
PUBCHEM
227397
Created by admin on Sat Dec 16 19:27:24 GMT 2023 , Edited by admin on Sat Dec 16 19:27:24 GMT 2023
PRIMARY