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

Details

Stereochemistry MIXED
Molecular Formula C7H14O3
Molecular Weight 146.1843
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 3-HYDROXY-2-METHYLBUTYRATE

SMILES

CCOC(=O)C(C)C(C)O

InChI

InChIKey=BZFWGBFTIQSEBN-UHFFFAOYSA-N
InChI=1S/C7H14O3/c1-4-10-7(9)5(2)6(3)8/h5-6,8H,4H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C7H14O3
Molecular Weight 146.1843
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:48:59 GMT 2023
Edited
by admin
on Fri Dec 15 19:48:59 GMT 2023
Record UNII
MQ1HS6P9B1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL 3-HYDROXY-2-METHYLBUTYRATE
Systematic Name English
(±)-ETHYL 3-HYDROXY-2-METHYLBUTYRATE [FHFI]
Common Name English
BUTANOIC ACID, 3-HYDROXY-2-METHYL-, ETHYL ESTER
Common Name English
ETHYL 3-HYDROXY-2-METHYLBUTYRATE, (±)-
Systematic Name English
BUTYRIC ACID, 3-HYDROXY-2-METHYL-, ETHYL ESTER
Common Name English
(±)-ETHYL 3-HYDROXY-2-METHYLBUTYRATE
FHFI  
Systematic Name English
FEMA NO. 4391
Code English
Code System Code Type Description
FDA UNII
MQ1HS6P9B1
Created by admin on Fri Dec 15 19:48:59 GMT 2023 , Edited by admin on Fri Dec 15 19:48:59 GMT 2023
PRIMARY
JECFA MONOGRAPH
1927
Created by admin on Fri Dec 15 19:48:59 GMT 2023 , Edited by admin on Fri Dec 15 19:48:59 GMT 2023
PRIMARY
PUBCHEM
656467
Created by admin on Fri Dec 15 19:48:59 GMT 2023 , Edited by admin on Fri Dec 15 19:48:59 GMT 2023
PRIMARY
CAS
27372-03-8
Created by admin on Fri Dec 15 19:48:59 GMT 2023 , Edited by admin on Fri Dec 15 19:48:59 GMT 2023
PRIMARY
EPA CompTox
DTXSID60950072
Created by admin on Fri Dec 15 19:48:59 GMT 2023 , Edited by admin on Fri Dec 15 19:48:59 GMT 2023
PRIMARY