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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H8ClNO3
Molecular Weight 201.607
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Chloromethyl m-nitrobenzyl ether

SMILES

[O-][N+](=O)C1=CC=CC(COCCl)=C1

InChI

InChIKey=YNEGTYXPKSYRQH-UHFFFAOYSA-N
InChI=1S/C8H8ClNO3/c9-6-13-5-7-2-1-3-8(4-7)10(11)12/h1-4H,5-6H2

HIDE SMILES / InChI

Approval Year

Name Type Language
Chloromethyl m-nitrobenzyl ether
Systematic Name English
NSC-83566
Preferred Name English
Benzene, 1-((chloromethoxy)methyl)-3-nitro-
Systematic Name English
1-[(Chloromethoxy)methyl]-3-nitrobenzene
Systematic Name English
m-Nitrobenzyloxymethyl chloride
Systematic Name English
Code System Code Type Description
PUBCHEM
96644
Created by admin on Tue Apr 01 19:52:37 GMT 2025 , Edited by admin on Tue Apr 01 19:52:37 GMT 2025
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EPA CompTox
DTXSID4068953
Created by admin on Tue Apr 01 19:52:37 GMT 2025 , Edited by admin on Tue Apr 01 19:52:37 GMT 2025
PRIMARY
CAS
54397-20-5
Created by admin on Tue Apr 01 19:52:37 GMT 2025 , Edited by admin on Tue Apr 01 19:52:37 GMT 2025
PRIMARY
NSC
83566
Created by admin on Tue Apr 01 19:52:37 GMT 2025 , Edited by admin on Tue Apr 01 19:52:37 GMT 2025
PRIMARY
FDA UNII
B7J5X6HLS3
Created by admin on Tue Apr 01 19:52:37 GMT 2025 , Edited by admin on Tue Apr 01 19:52:37 GMT 2025
PRIMARY