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Details

Stereochemistry MIXED
Molecular Formula C8H12O2
Molecular Weight 140.1797
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-ETHYL-5-METHYL-1,2-CYCLOPENTANEDIONE

SMILES

CCC1CC(C)C(=O)C1=O

InChI

InChIKey=CMIUAOYKUMNWLW-UHFFFAOYSA-N
InChI=1S/C8H12O2/c1-3-6-4-5(2)7(9)8(6)10/h5-6H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C8H12O2
Molecular Weight 140.1797
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:44:32 GMT 2023
Edited
by admin
on Fri Dec 15 19:44:32 GMT 2023
Record UNII
K6LG66ON3H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-ETHYL-5-METHYL-1,2-CYCLOPENTANEDIONE
Systematic Name English
5-ETHYL-3-METHYL CYCLOTENE
Common Name English
FEMA NO. 3454
Code English
2-CYCLOPENTEN-1-ONE, 3-ETHYL-2-HYDROXY-5-METHYL-
Systematic Name English
5-ETHYL-3-METHYLCYCLOTENE
Common Name English
5-ETHYL-2-HYDROXY-3-METHYLCYCLOPENT-2-EN-1-ONE
Systematic Name English
(±)-5-ETHYL-2-HYDROXY-3-METHYL-2-CYCLOPENTEN-1-ONE
Systematic Name English
5-ETHYL-2-HYDROXY-3-METHYL-2-CYCLOPENTEN-1-ONE
Systematic Name English
5-ETHYL-2-HYDROXY-3-METHYL-CYCLOPENT-2-EN-1-ONE
FHFI  
Systematic Name English
5-ETHYL-2-HYDROXY-3-METHYL-2-CYCLOPENTEN-1-ONE, (±)-
Systematic Name English
5-ETHYL-2-HYDROXY-3-METHYL-CYCLOPENT-2-EN-1-ONE [FHFI]
Common Name English
1,2-CYCLOPENTANEDIONE, 3-ETHYL-5-METHYL-
Systematic Name English
2-CYCLOPENTEN-1-ONE, 5-ETHYL-2-HYDROXY-3-METHYL-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
258-451-6
Created by admin on Fri Dec 15 19:44:32 GMT 2023 , Edited by admin on Fri Dec 15 19:44:32 GMT 2023
PRIMARY
FDA UNII
K6LG66ON3H
Created by admin on Fri Dec 15 19:44:32 GMT 2023 , Edited by admin on Fri Dec 15 19:44:32 GMT 2023
PRIMARY
CAS
71608-11-2
Created by admin on Fri Dec 15 19:44:32 GMT 2023 , Edited by admin on Fri Dec 15 19:44:32 GMT 2023
PRIMARY
CAS
58228-72-1
Created by admin on Fri Dec 15 19:44:32 GMT 2023 , Edited by admin on Fri Dec 15 19:44:32 GMT 2023
ALTERNATIVE
JECFA MONOGRAPH
430
Created by admin on Fri Dec 15 19:44:32 GMT 2023 , Edited by admin on Fri Dec 15 19:44:32 GMT 2023
PRIMARY
CAS
53263-58-4
Created by admin on Fri Dec 15 19:44:32 GMT 2023 , Edited by admin on Fri Dec 15 19:44:32 GMT 2023
ALTERNATIVE
PUBCHEM
15825502
Created by admin on Fri Dec 15 19:44:32 GMT 2023 , Edited by admin on Fri Dec 15 19:44:32 GMT 2023
PRIMARY
EPA CompTox
DTXSID40967840
Created by admin on Fri Dec 15 19:44:32 GMT 2023 , Edited by admin on Fri Dec 15 19:44:32 GMT 2023
PRIMARY