(2-Methyl-2-nitropropyl)(propan-2-yl)amine

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Basic information

CAS: 89850-87-3
Standard SMILES: CC(C)NCC(C)(C)[N+](=O)[O-]
InChIKey: RJWPORRWKYCXJF-UHFFFAOYSA-N
Molecular formula: C7H16N2O2
Average molar mass: 160.21 g/mol
Monoisotopic mass: 160.12117776

Names & identifiers

Preferred name: (2-Methyl-2-nitropropyl)(propan-2-yl)amine
IUPAC: 2-methyl-2-nitro-N-propan-2-ylpropan-1-amine

Names & synonyms

89850-87-3NSC17723(2-methyl-2-nitropropyl)(propan-2-yl)amineSCHEMBL10793151DTXSID601009021NSC-17723AKOS0407916462-methyl-2-nitro-N-(propan-2-yl)propan-1-amine

Database identifiers

CAS: 89850-87-3
PubChem CID: 226846
DTXSID: DTXSID601009021

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 57.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 11
Formal charge: 0
Complexity: 138

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Compound notes

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