4-Chloro-N,N-dimethyl-3-nitrobenzamide

HCID 220103

Notes Reactions

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Basic information

CAS: 5334-04-3
Standard SMILES: CN(C)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1
InChIKey: RIOXTSMUEXTUSK-UHFFFAOYSA-N
Molecular formula: C9H9ClN2O3
Average molar mass: 228.63 g/mol
Monoisotopic mass: 228.0301698

Names & identifiers

Preferred name: 4-Chloro-N,N-dimethyl-3-nitrobenzamide
IUPAC: 4-chloro-N,N-dimethyl-3-nitrobenzamide

Names & synonyms

4-CHLORO-N,N-DIMETHYL-3-NITROBENZAMIDE5334-04-3MFCD01211934NSC2378Oprea1_155439SCHEMBL5913044SCHEMBL31272847DTXSID10967953RIOXTSMUEXTUSK-UHFFFAOYSA-NNSC-2378AKOS0001569874-chloro-N,N-dimethyl-3-nitro-benzamide

Show more names

BS-41533N,N-dimethyl-3-nitro-4-chloro-benzamideF313277

Database identifiers

CAS: 5334-04-3
PubChem CID: 220103
DTXSID: DTXSID10967953

Properties

Computed structural properties

XLogP: 1.7
Topological polar surface area: 66.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 15
Formal charge: 0
Complexity: 265

Related reactions

3 records

New reaction record

HRID 1532666As productuspto-grants-2001_03

HRID 1532667As reactantuspto-grants-2001_03

HRID 1532694As reactantuspto-grants-2001_03

Compound notes

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