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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H7ClO3
Molecular Weight 174.582
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 5-chloromethyl-2-furoate

SMILES

COC(=O)C1=CC=C(CCl)O1

InChI

InChIKey=PWXMEBZOKUPCST-UHFFFAOYSA-N
InChI=1S/C7H7ClO3/c1-10-7(9)6-3-2-5(4-8)11-6/h2-3H,4H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-117334
Preferred Name English
Methyl 5-chloromethyl-2-furoate
Common Name English
Methyl 5-(chloromethyl)-2-furoate
Systematic Name English
2-Furancarboxylic acid, 5-(chloromethyl)-, methyl ester
Systematic Name English
Code System Code Type Description
FDA UNII
8E8QKZ9S9D
Created by admin on Wed Apr 02 21:24:09 GMT 2025 , Edited by admin on Wed Apr 02 21:24:09 GMT 2025
PRIMARY
NSC
117334
Created by admin on Wed Apr 02 21:24:09 GMT 2025 , Edited by admin on Wed Apr 02 21:24:09 GMT 2025
PRIMARY
ECHA (EC/EINECS)
218-405-8
Created by admin on Wed Apr 02 21:24:09 GMT 2025 , Edited by admin on Wed Apr 02 21:24:09 GMT 2025
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CAS
2144-37-8
Created by admin on Wed Apr 02 21:24:09 GMT 2025 , Edited by admin on Wed Apr 02 21:24:09 GMT 2025
PRIMARY
EPA CompTox
DTXSID40175706
Created by admin on Wed Apr 02 21:24:09 GMT 2025 , Edited by admin on Wed Apr 02 21:24:09 GMT 2025
PRIMARY
PUBCHEM
75065
Created by admin on Wed Apr 02 21:24:09 GMT 2025 , Edited by admin on Wed Apr 02 21:24:09 GMT 2025
PRIMARY