N-Nitroso-propyl-(alpha-hydroperoxypropyl)amine

HCID 53146

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Basic information

CAS: 74940-24-2
Standard SMILES: CCCN(N=O)C(CC)OO
InChIKey: MXAWWSHSOXHLBL-UHFFFAOYSA-N
Molecular formula: C6H14N2O3
Average molar mass: 162.19 g/mol
Monoisotopic mass: 162.10044231

Names & identifiers

Preferred name: N-Nitroso-propyl-(alpha-hydroperoxypropyl)amine
IUPAC: N-(1-hydroperoxypropyl)-N-propylnitrous amide

Names & synonyms

74940-24-2BRN 4377381N-Nitroso-propyl-(alpha-hydroperoxypropyl)amine1-(Hydroperoxy)-N-nitrosodipropylamineN-Propyl-N-(alpha-hydroperoxypropyl)nitrosamineDIPROPYLAMINE, 1-(HYDROPEROXY)-N-NITROSO-N-(1-hydroperoxypropyl)-N-propylnitrous amideDTXSID30996447

Database identifiers

CAS: 74940-24-2
PubChem CID: 53146
DTXSID: DTXSID30996447

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 62.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 5
Heavy atoms: 11
Formal charge: 0
Complexity: 110

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