N,N-diethyl-6,8-dinitro-4-phenylnaphthalen-2-amine

HCID 323271

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Basic information

CAS: 51911-76-3
Standard SMILES: CCN(CC)c1cc(-c2ccccc2)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2c1
InChIKey: XEAOAMGUXAKOSK-UHFFFAOYSA-N
Molecular formula: C20H19N3O4
Average molar mass: 365.4 g/mol
Monoisotopic mass: 365.1375561

Names & identifiers

Preferred name: N,N-diethyl-6,8-dinitro-4-phenylnaphthalen-2-amine
IUPAC: N,N-diethyl-6,8-dinitro-4-phenylnaphthalen-2-amine

Names & synonyms

51911-76-3N,N-diethyl-6,8-dinitro-4-phenylnaphthalen-2-amineNSC282166DTXSID40314375NSC-282166DS-011765N,N-diethyl-6,8-dinitro-4-phenyl-naphthalen-2-amine

Database identifiers

CAS: 51911-76-3
PubChem CID: 323271
DTXSID: DTXSID40314375

Properties

Computed structural properties

XLogP: 5.3
Topological polar surface area: 94.9 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 4
Heavy atoms: 27
Formal charge: 0
Complexity: 522

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