2,2-Dibromo-1-methylcyclopropanecarboxylic acid 2-[1-(4-nitrophenyl)ethylidene]hydrazide

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Basic information

CAS: 350989-96-7
Standard SMILES: CC(=NNC(=O)C1(C)CC1(Br)Br)c1ccc([N+](=O)[O-])cc1
InChIKey: JPDGNLRGTHOXIJ-UHFFFAOYSA-N
Molecular formula: C13H13Br2N3O3
Average molar mass: 419.07 g/mol
Monoisotopic mass: 416.93237

Names & identifiers

Preferred name: 2,2-Dibromo-1-methylcyclopropanecarboxylic acid 2-[1-(4-nitrophenyl)ethylidene]hydrazide
IUPAC: 2,2-dibromo-1-methyl-N-[1-(4-nitrophenyl)ethylideneamino]cyclopropane-1-carboxamide

Names & synonyms

CBMicro_031505DTXSID101123474HMS2611E182,2-Dibromo-1-methylcyclopropanecarboxylic acid 2-[1-(4-nitrophenyl)ethylidene]hydrazide350989-96-72,2-DIBROMO-1-METHYL-N'-[1-(4-NITROPHENYL)ETHYLIDENE]CYCLOPROPANE-1-CARBOHYDRAZIDE

Database identifiers

CAS: 350989-96-7
PubChem CID: 2887372
DTXSID: DTXSID101123474

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 87.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 21
Formal charge: 0
Complexity: 482

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Compound notes

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