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

Details

Stereochemistry ABSOLUTE
Molecular Formula C14H16F2O3
Molecular Weight 270.2718
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-[2-(2,4-difluorophenyl)prop-2-en-1-yl]-3-hydroxypropyl acetate, (2S)-

SMILES

CC(=O)OC[C@H](CO)CC(=C)C1=C(F)C=C(F)C=C1

InChI

InChIKey=XILJVAFOAYTQOP-NSHDSACASA-N
InChI=1S/C14H16F2O3/c1-9(5-11(7-17)8-19-10(2)18)13-4-3-12(15)6-14(13)16/h3-4,6,11,17H,1,5,7-8H2,2H3/t11-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
2-[2-(2,4-difluorophenyl)prop-2-en-1-yl]-3-hydroxypropyl acetate, (2S)-
Systematic Name English
1,3-Propanediol, 2-[2-(2,4-difluorophenyl)-2-propenyl]-, monoacetate, (S)-
Systematic Name English
[(2S)-4-(2,4-difluorophenyl)-2-(hydroxymethyl)pent-4-enyl] acetate
Systematic Name English
1,3-Propanediol, 2-[2-(2,4-difluorophenyl)-2-propen-1-yl]-, 1-acetate, (2S)-
Systematic Name English
(2S)-2-[2-(2,4-difluorophenyl)prop-2-en-1-yl]-3-hydroxypropyl acetate
Systematic Name English
Code System Code Type Description
FDA UNII
GLZ6WHX9QF
Created by admin on Sat Dec 16 19:52:13 GMT 2023 , Edited by admin on Sat Dec 16 19:52:13 GMT 2023
PRIMARY
CAS
169266-09-5
Created by admin on Sat Dec 16 19:52:13 GMT 2023 , Edited by admin on Sat Dec 16 19:52:13 GMT 2023
PRIMARY
PUBCHEM
11807751
Created by admin on Sat Dec 16 19:52:13 GMT 2023 , Edited by admin on Sat Dec 16 19:52:13 GMT 2023
PRIMARY