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Details

Stereochemistry MIXED
Molecular Formula C13H18O4
Molecular Weight 238.2796
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(2-(BENZOYLOXY)PROPOXY)-2-PROPANOL

SMILES

CC(O)COCC(C)OC(=O)C1=CC=CC=C1

InChI

InChIKey=AGNBBDBWPQFJKS-UHFFFAOYSA-N
InChI=1S/C13H18O4/c1-10(14)8-16-9-11(2)17-13(15)12-6-4-3-5-7-12/h3-7,10-11,14H,8-9H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C13H18O4
Molecular Weight 238.2796
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 Sat Dec 16 11:25:33 GMT 2023
Edited
by admin
on Sat Dec 16 11:25:33 GMT 2023
Record UNII
2794I1AO7A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(2-(BENZOYLOXY)PROPOXY)-2-PROPANOL
Systematic Name English
DI(1,2-PROPYLENE GLYCOL) MONOBENZOATE, TAIL TO TAIL-
Common Name English
2-PROPANOL, 1-(2-(BENZOYLOXY)PROPOXY)-
Systematic Name English
Code System Code Type Description
CAS
159964-47-3
Created by admin on Sat Dec 16 11:25:33 GMT 2023 , Edited by admin on Sat Dec 16 11:25:33 GMT 2023
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FDA UNII
2794I1AO7A
Created by admin on Sat Dec 16 11:25:33 GMT 2023 , Edited by admin on Sat Dec 16 11:25:33 GMT 2023
PRIMARY
PUBCHEM
101627490
Created by admin on Sat Dec 16 11:25:33 GMT 2023 , Edited by admin on Sat Dec 16 11:25:33 GMT 2023
PRIMARY