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Details

Stereochemistry ACHIRAL
Molecular Formula C6H12O
Molecular Weight 100.1589
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Methyl-2-pentanone, (±)-

SMILES

CCC(C)C(C)=O

InChI

InChIKey=UIHCLUNTQKBZGK-UHFFFAOYSA-N
InChI=1S/C6H12O/c1-4-5(2)6(3)7/h5H,4H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C6H12O
Molecular Weight 100.1589
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:13:54 GMT 2025
Edited
by admin
on Mon Mar 31 22:13:54 GMT 2025
Record UNII
S6QAE3S2Z8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-66492
Preferred Name English
3-Methyl-2-pentanone, (±)-
Systematic Name English
(±)-3-Methyl-2-pentanone
Systematic Name English
Methyl sec-butyl ketone
Systematic Name English
Methyl 1-methylpropyl ketone
Systematic Name English
3-Methyl-2-pentanone
Systematic Name English
Code System Code Type Description
WIKIPEDIA
3-Methyl-2-pentanone
Created by admin on Mon Mar 31 22:13:54 GMT 2025 , Edited by admin on Mon Mar 31 22:13:54 GMT 2025
PRIMARY
PUBCHEM
11262
Created by admin on Mon Mar 31 22:13:54 GMT 2025 , Edited by admin on Mon Mar 31 22:13:54 GMT 2025
PRIMARY
FDA UNII
S6QAE3S2Z8
Created by admin on Mon Mar 31 22:13:54 GMT 2025 , Edited by admin on Mon Mar 31 22:13:54 GMT 2025
PRIMARY
CAS
565-61-7
Created by admin on Mon Mar 31 22:13:54 GMT 2025 , Edited by admin on Mon Mar 31 22:13:54 GMT 2025
PRIMARY
ECHA (EC/EINECS)
209-282-1
Created by admin on Mon Mar 31 22:13:54 GMT 2025 , Edited by admin on Mon Mar 31 22:13:54 GMT 2025
PRIMARY
NSC
66492
Created by admin on Mon Mar 31 22:13:54 GMT 2025 , Edited by admin on Mon Mar 31 22:13:54 GMT 2025
PRIMARY
EPA CompTox
DTXSID4021634
Created by admin on Mon Mar 31 22:13:54 GMT 2025 , Edited by admin on Mon Mar 31 22:13:54 GMT 2025
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE