2-(Chloromethyl)-1-methyl-4-nitrobenzene structure

2-(Chloromethyl)-1-methyl-4-nitrobenzene

2-(chloromethyl)-1-methyl-4-nitrobenzene

Also Known As: 2-(chloromethyl)-1-methyl-4-nitrobenzene|2-Methyl-5-nitrobenzyl chloride|2- -1-methyl-4-nitrobenzene|Benzene, 2-(chloromethyl)-1-methyl-4-nitro-|3-chloromethyl-4-methylnitrobenzene|8759AB|2-(chloromethyl)-1-methyl-4-nitro-benzene|4CH-021673|Benzene,2-(chloromethyl)-1-methyl-4-nitro-|966C248|Benzene, 2-(chloromethyl)-1-methyl-4-nitro- (9CI)|859-307-0

CAS: 6583-90-0
Molecular Formula C8H8ClNO2
Molecular Weight 185.02435 g/mol
LogP 2.9
Topological Polar Surface Area 45.8 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 1
Exact Mass 185.02435
Monoisotopic Mass 185.02435
Heavy Atoms 12
Complexity 169.0

Chemical Identifiers

CAS Number 6583-90-0
SMILES CC1=C(C=C(C=C1)[N+](=O)[O-])CCl
InChIKey HBCZMIJXNQCIDC-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (15 patents) Biotechnology (10 patents) Heterocyclic Building Blocks (19 patents) Organic Building Blocks (36 patents) Pharmaceutical Intermediates (21 patents)

Product Overview

2-(Chloromethyl)-1-methyl-4-nitrobenzene (CAS 6583-90-0), with molecular formula C8H8ClNO2 and molecular weight 185.02435 g/mol. IUPAC: 2-(chloromethyl)-1-methyl-4-nitrobenzene.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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