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Details

Stereochemistry RACEMIC
Molecular Formula C7H14O3
Molecular Weight 146.1843
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-BUTYLENE GLYCOL 3-PROPIONATE

SMILES

CCC(=O)OC(C)CCO

InChI

InChIKey=IGNNGXSXKJYBTM-UHFFFAOYSA-N
InChI=1S/C7H14O3/c1-3-7(9)10-6(2)4-5-8/h6,8H,3-5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C7H14O3
Molecular Weight 146.1843
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 Sat Dec 16 01:21:26 GMT 2023
Edited
by admin
on Sat Dec 16 01:21:26 GMT 2023
Record UNII
72L1C5DO6J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-BUTYLENE GLYCOL 3-PROPIONATE
Common Name English
(±)-1,3-BUTANEDIOL, 3-PROPANOATE
Systematic Name English
1,3-BUTANEDIOL, 3-PROPANOATE
Systematic Name English
1,3-BUTANEDIOL, 3-PROPANOATE, (±)-
Systematic Name English
Code System Code Type Description
FDA UNII
72L1C5DO6J
Created by admin on Sat Dec 16 01:21:26 GMT 2023 , Edited by admin on Sat Dec 16 01:21:26 GMT 2023
PRIMARY
PUBCHEM
20254441
Created by admin on Sat Dec 16 01:21:26 GMT 2023 , Edited by admin on Sat Dec 16 01:21:26 GMT 2023
PRIMARY
CAS
89457-40-9
Created by admin on Sat Dec 16 01:21:26 GMT 2023 , Edited by admin on Sat Dec 16 01:21:26 GMT 2023
PRIMARY