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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H14O
Molecular Weight 138.2069
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-ISOPROPYL-3-METHYL-2-CYCLOPENTENONE

SMILES

CC(C)C1=C(C)CCC1=O

InChI

InChIKey=MZTOBWCRJYWMLL-UHFFFAOYSA-N
InChI=1S/C9H14O/c1-6(2)9-7(3)4-5-8(9)10/h6H,4-5H2,1-3H3

HIDE SMILES / InChI

Approval Year

Name Type Language
2-CYCLOPENTEN-1-ONE, 3-METHYL-2-(1-METHYLETHYL)-
Preferred Name English
2-ISOPROPYL-3-METHYL-2-CYCLOPENTENONE
Systematic Name English
3-METHYL-2-(1-METHYLETHYL)-2-CYCLOPENTEN-1-ONE
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
250-458-2
Created by admin on Tue Apr 01 18:45:56 GMT 2025 , Edited by admin on Tue Apr 01 18:45:56 GMT 2025
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PUBCHEM
169253
Created by admin on Tue Apr 01 18:45:56 GMT 2025 , Edited by admin on Tue Apr 01 18:45:56 GMT 2025
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FDA UNII
A69K8OA38Q
Created by admin on Tue Apr 01 18:45:56 GMT 2025 , Edited by admin on Tue Apr 01 18:45:56 GMT 2025
PRIMARY
CAS
31089-24-4
Created by admin on Tue Apr 01 18:45:56 GMT 2025 , Edited by admin on Tue Apr 01 18:45:56 GMT 2025
PRIMARY
EPA CompTox
DTXSID1067594
Created by admin on Tue Apr 01 18:45:56 GMT 2025 , Edited by admin on Tue Apr 01 18:45:56 GMT 2025
PRIMARY