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N-(3,4-dichlorophenyl)-4-methoxy-3-nitrobenzamide

HCID 711534
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Basic information

CAS
328259-32-1
Standard SMILES
COc1ccc(C(=O)Nc2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-]
InChIKey
AFBAGNAURTYVJS-UHFFFAOYSA-N
Molecular formula
C14H10Cl2N2O4
Average molar mass
341.1 g/mol
Monoisotopic mass
340.0017622

Names & identifiers

Preferred name
N-(3,4-dichlorophenyl)-4-methoxy-3-nitrobenzamide
IUPAC
N-(3,4-dichlorophenyl)-4-methoxy-3-nitrobenzamide

Names & synonyms

N-(3,4-dichlorophenyl)-4-methoxy-3-nitrobenzamideOprea1_478692Oprea1_784377N-(3,4-dichlorophenyl)-3-nitro-4-methoxybenzamideSCHEMBL17512401STL260148AKOS000514861CCG-338162328259-32-1ST011234AG-690/36389016N-(3,4-dichlorophenyl)(4-methoxy-3-nitrophenyl)carboxamide

Database identifiers

CAS
328259-32-1
PubChem CID
711534
EC Number
140-873-6

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
84.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
22
Formal charge
0
Complexity
418

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]

P273, P391, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAquatic Acute 1 (100%)

Related reactions

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Compound notes

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