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Details

Stereochemistry RACEMIC
Molecular Formula C9H18O3
Molecular Weight 174.2374
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PROPYLENE GLYCOL 2-HEXANOATE

SMILES

CCCCCC(=O)OC(C)CO

InChI

InChIKey=PWNFTZZOSNXDLA-UHFFFAOYSA-N
InChI=1S/C9H18O3/c1-3-4-5-6-9(11)12-8(2)7-10/h8,10H,3-7H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C9H18O3
Molecular Weight 174.2374
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 20:40:06 GMT 2025
Edited
by admin
on Mon Mar 31 20:40:06 GMT 2025
Record UNII
39RQR15921
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FEMA NO. 4469, 2-HYDROXY-1-METHYLETHYL-
Preferred Name English
PROPYLENE GLYCOL 2-HEXANOATE
Common Name English
HEXANOIC ACID, 2-HYDROXY-1-METHYLETHYL ESTER
Common Name English
2-PROPYLENE GLYCOL HEXANOATE
Common Name English
(±)-(2-HYDROXY-1-METHYL-ETHYL) HEXANOATE
Systematic Name English
2-HYDROXY-1-METHYLETHYL HEXANOATE
Systematic Name English
(2-HYDROXY-1-METHYL-ETHYL) HEXANOATE
Systematic Name English
(2-HYDROXY-1-METHYL-ETHYL) HEXANOATE, (±)-
Systematic Name English
Code System Code Type Description
FDA UNII
39RQR15921
Created by admin on Mon Mar 31 20:40:06 GMT 2025 , Edited by admin on Mon Mar 31 20:40:06 GMT 2025
PRIMARY
CAS
170678-49-6
Created by admin on Mon Mar 31 20:40:06 GMT 2025 , Edited by admin on Mon Mar 31 20:40:06 GMT 2025
PRIMARY
PUBCHEM
11073907
Created by admin on Mon Mar 31 20:40:06 GMT 2025 , Edited by admin on Mon Mar 31 20:40:06 GMT 2025
PRIMARY