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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H10O2
Molecular Weight 126.1531
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

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

SMILES

COC1=C(C)CCC1=O

InChI

InChIKey=GTEGQQAMGYNDKS-UHFFFAOYSA-N
InChI=1S/C7H10O2/c1-5-3-4-6(8)7(5)9-2/h3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C7H10O2
Molecular Weight 126.1531
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:48:39 GMT 2025
Edited
by admin
on Mon Mar 31 19:48:39 GMT 2025
Record UNII
KK59159647
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-177460
Preferred Name English
2-METHOXY-3-METHYL-2-CYCLOPENTENONE
Systematic Name English
2-METHOXY-3-METHYL-2-CYCLOPENTEN-1-ONE
Systematic Name English
2-CYCLOPENTEN-1-ONE, 2-METHOXY-3-METHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
KK59159647
Created by admin on Mon Mar 31 19:48:39 GMT 2025 , Edited by admin on Mon Mar 31 19:48:39 GMT 2025
PRIMARY
NSC
177460
Created by admin on Mon Mar 31 19:48:39 GMT 2025 , Edited by admin on Mon Mar 31 19:48:39 GMT 2025
PRIMARY
PUBCHEM
84249
Created by admin on Mon Mar 31 19:48:39 GMT 2025 , Edited by admin on Mon Mar 31 19:48:39 GMT 2025
PRIMARY
EPA CompTox
DTXSID5065724
Created by admin on Mon Mar 31 19:48:39 GMT 2025 , Edited by admin on Mon Mar 31 19:48:39 GMT 2025
PRIMARY
CAS
14189-85-6
Created by admin on Mon Mar 31 19:48:39 GMT 2025 , Edited by admin on Mon Mar 31 19:48:39 GMT 2025
PRIMARY
ECHA (EC/EINECS)
238-042-9
Created by admin on Mon Mar 31 19:48:39 GMT 2025 , Edited by admin on Mon Mar 31 19:48:39 GMT 2025
PRIMARY