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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H16O
Molecular Weight 140.2227
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Isopropylcyclohexanone

SMILES

CC(C)C1CCC(=O)CC1

InChI

InChIKey=FPKISACHVIIMRA-UHFFFAOYSA-N
InChI=1S/C9H16O/c1-7(2)8-3-5-9(10)6-4-8/h7-8H,3-6H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-21125
Preferred Name English
4-Isopropylcyclohexanone
Systematic Name English
4-Isopropylcyclohexan-1-one
Systematic Name English
Cyclohexanone, 4-(1-methylethyl)-
Systematic Name English
AI3-39194
Code English
Cyclohexanone, 4-isopropyl-
Systematic Name English
Code System Code Type Description
NSC
21125
Created by admin on Tue Apr 01 19:35:10 GMT 2025 , Edited by admin on Tue Apr 01 19:35:10 GMT 2025
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FDA UNII
JA8S3CU9U5
Created by admin on Tue Apr 01 19:35:10 GMT 2025 , Edited by admin on Tue Apr 01 19:35:10 GMT 2025
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EPA CompTox
DTXSID4063878
Created by admin on Tue Apr 01 19:35:10 GMT 2025 , Edited by admin on Tue Apr 01 19:35:10 GMT 2025
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ECHA (EC/EINECS)
226-592-2
Created by admin on Tue Apr 01 19:35:10 GMT 2025 , Edited by admin on Tue Apr 01 19:35:10 GMT 2025
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CAS
5432-85-9
Created by admin on Tue Apr 01 19:35:10 GMT 2025 , Edited by admin on Tue Apr 01 19:35:10 GMT 2025
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PUBCHEM
79488
Created by admin on Tue Apr 01 19:35:10 GMT 2025 , Edited by admin on Tue Apr 01 19:35:10 GMT 2025
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