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Details

Stereochemistry ACHIRAL
Molecular Formula C5H10O2
Molecular Weight 102.1317
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Hydroxy-3-methyl-2-butanone

SMILES

CC(=O)C(C)(C)O

InChI

InChIKey=BNDRWEVUODOUDW-UHFFFAOYSA-N
InChI=1S/C5H10O2/c1-4(6)5(2,3)7/h7H,1-3H3

HIDE SMILES / InChI

Molecular Formula C5H10O2
Molecular Weight 102.1317
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 Tue Apr 01 19:57:26 GMT 2025
Edited
by admin
on Tue Apr 01 19:57:26 GMT 2025
Record UNII
YYL6RC5VC2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-5576
Preferred Name English
3-Hydroxy-3-methyl-2-butanone
Systematic Name English
Methylacetoin
Common Name English
1-Hydroxy-1-methylethyl methyl ketone
Systematic Name English
3-Methylacetoin
Common Name English
2-Butanone, 3-hydroxy-3-methyl-
Systematic Name English
Acetyldimethylcarbinol
Common Name English
2-Methyl-2-hydroxy-3-butanone
Common Name English
Dimethylacetylcarbinol
Common Name English
Code System Code Type Description
FDA UNII
YYL6RC5VC2
Created by admin on Tue Apr 01 19:57:26 GMT 2025 , Edited by admin on Tue Apr 01 19:57:26 GMT 2025
PRIMARY
CAS
115-22-0
Created by admin on Tue Apr 01 19:57:26 GMT 2025 , Edited by admin on Tue Apr 01 19:57:26 GMT 2025
PRIMARY
PUBCHEM
8261
Created by admin on Tue Apr 01 19:57:26 GMT 2025 , Edited by admin on Tue Apr 01 19:57:26 GMT 2025
PRIMARY
NSC
5576
Created by admin on Tue Apr 01 19:57:26 GMT 2025 , Edited by admin on Tue Apr 01 19:57:26 GMT 2025
PRIMARY
EPA CompTox
DTXSID60870468
Created by admin on Tue Apr 01 19:57:26 GMT 2025 , Edited by admin on Tue Apr 01 19:57:26 GMT 2025
PRIMARY
ECHA (EC/EINECS)
204-073-1
Created by admin on Tue Apr 01 19:57:26 GMT 2025 , Edited by admin on Tue Apr 01 19:57:26 GMT 2025
PRIMARY