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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H16O4
Molecular Weight 188.2209
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NEOPENTYL GLYCOL DIACETATE

SMILES

CC(=O)OCC(C)(C)COC(C)=O

InChI

InChIKey=ZFFGZCTVZNNVLP-UHFFFAOYSA-N
InChI=1S/C9H16O4/c1-7(10)12-5-9(3,4)6-13-8(2)11/h5-6H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C9H16O4
Molecular Weight 188.2209
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 06:18:01 GMT 2023
Edited
by admin
on Sat Dec 16 06:18:01 GMT 2023
Record UNII
78L90CO7ZF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NEOPENTYL GLYCOL DIACETATE
Systematic Name English
NSC-69071
Code English
1,3-PROPANEDIOL, 2,2-DIMETHYL-, DIACETATE
Systematic Name English
1,3-PROPANEDIOL, 2,2-DIMETHYL-, 1,3-DIACETATE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50158641
Created by admin on Sat Dec 16 06:18:01 GMT 2023 , Edited by admin on Sat Dec 16 06:18:01 GMT 2023
PRIMARY
NSC
69071
Created by admin on Sat Dec 16 06:18:01 GMT 2023 , Edited by admin on Sat Dec 16 06:18:01 GMT 2023
PRIMARY
FDA UNII
78L90CO7ZF
Created by admin on Sat Dec 16 06:18:01 GMT 2023 , Edited by admin on Sat Dec 16 06:18:01 GMT 2023
PRIMARY
PUBCHEM
83442
Created by admin on Sat Dec 16 06:18:01 GMT 2023 , Edited by admin on Sat Dec 16 06:18:01 GMT 2023
PRIMARY
CAS
13431-57-7
Created by admin on Sat Dec 16 06:18:01 GMT 2023 , Edited by admin on Sat Dec 16 06:18:01 GMT 2023
PRIMARY