1-Nitro-3-[(trichloromethyl)sulfanyl]benzene structure

1-Nitro-3-[(trichloromethyl)sulfanyl]benzene

1-nitro-3-(trichloromethylsulfanyl)benzene

Also Known As: 1-nitro-3-(trichloromethylsulfanyl)benzene|1-Nitro-3-[(trichloromethyl)sulfanyl]benzene

CAS: 90109-81-2
Molecular Formula C7H4Cl3NO2S
Molecular Weight 270.90283 g/mol
LogP 4.2
Topological Polar Surface Area 71.1 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 1
Exact Mass 270.90283
Monoisotopic Mass 270.90283
Heavy Atoms 14
Complexity 216.0

Chemical Identifiers

CAS Number 90109-81-2
SMILES C1=CC(=CC(=C1)SC(Cl)(Cl)Cl)[N+](=O)[O-]
InChIKey NXEPDBIXRWVATM-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Heterocyclic Building Blocks (1 patents) Pharmaceutical Intermediates (1 patents)

Product Overview

1-Nitro-3-[(trichloromethyl)sulfanyl]benzene (CAS 90109-81-2), with molecular formula C7H4Cl3NO2S and molecular weight 270.90283 g/mol. IUPAC: 1-nitro-3-(trichloromethylsulfanyl)benzene.

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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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