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

Details

Stereochemistry RACEMIC
Molecular Formula C15H23ClO4
Molecular Weight 302.794
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-Chloro-3-[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]-2-propanol

SMILES

CC(C)OCCOCC1=CC=C(OCC(O)CCl)C=C1

InChI

InChIKey=HSEVECVZUONZIP-UHFFFAOYSA-N
InChI=1S/C15H23ClO4/c1-12(2)19-8-7-18-10-13-3-5-15(6-4-13)20-11-14(17)9-16/h3-6,12,14,17H,7-11H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C15H23ClO4
Molecular Weight 302.794
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 19:29:20 GMT 2023
Edited
by admin
on Sat Dec 16 19:29:20 GMT 2023
Record UNII
83WH4SXS6F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-Chloro-3-[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]-2-propanol
Systematic Name English
2-Propanol, 1-chloro-3-[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]-
Systematic Name English
Code System Code Type Description
FDA UNII
83WH4SXS6F
Created by admin on Sat Dec 16 19:29:20 GMT 2023 , Edited by admin on Sat Dec 16 19:29:20 GMT 2023
PRIMARY
CAS
704200-67-9
Created by admin on Sat Dec 16 19:29:20 GMT 2023 , Edited by admin on Sat Dec 16 19:29:20 GMT 2023
PRIMARY
PUBCHEM
69422977
Created by admin on Sat Dec 16 19:29:20 GMT 2023 , Edited by admin on Sat Dec 16 19:29:20 GMT 2023
PRIMARY