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Details

Stereochemistry ACHIRAL
Molecular Formula C8H8ClNO2
Molecular Weight 185.608
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of alpha-Chloro-2-methyl-3-nitrotoluene

SMILES

CC1=C(CCl)C=CC=C1[N+]([O-])=O

InChI

InChIKey=XZNDXQGZPOZITR-UHFFFAOYSA-N
InChI=1S/C8H8ClNO2/c1-6-7(5-9)3-2-4-8(6)10(11)12/h2-4H,5H2,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
alpha-Chloro-2-methyl-3-nitrotoluene
Systematic Name English
2-Methyl-3-nitrobenzyl chloride
Preferred Name English
Benzene, 1-(chloromethyl)-2-methyl-3-nitro-
Systematic Name English
1-(Chloromethyl)-2-methyl-3-nitrobenzene
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID40209212
Created by admin on Tue Apr 01 19:02:17 GMT 2025 , Edited by admin on Tue Apr 01 19:02:17 GMT 2025
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PUBCHEM
108947
Created by admin on Tue Apr 01 19:02:17 GMT 2025 , Edited by admin on Tue Apr 01 19:02:17 GMT 2025
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FDA UNII
9F9H65R9XM
Created by admin on Tue Apr 01 19:02:17 GMT 2025 , Edited by admin on Tue Apr 01 19:02:17 GMT 2025
PRIMARY
ECHA (EC/EINECS)
262-249-3
Created by admin on Tue Apr 01 19:02:17 GMT 2025 , Edited by admin on Tue Apr 01 19:02:17 GMT 2025
PRIMARY
CAS
60468-54-4
Created by admin on Tue Apr 01 19:02:17 GMT 2025 , Edited by admin on Tue Apr 01 19:02:17 GMT 2025
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