N-Butyl-N-(4-hydroxybutyl)nitrosamine

N-butyl-N-(4-hydroxybutyl)nitrous amide

CAS: 3817-11-6

Molecular Formula	`C8H18N2O2`
Molecular Weight	174.24 g/mol
LogP	1.4
Topological Polar Surface Area	52.9 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	174.13683
Heavy Atoms	12
Complexity	109.0

Chemical Identifiers

CAS Number	3817-11-6
SMILES	`CCCCN(CCCCO)N=O`
InChIKey	`DIKPQFXYECAYPC-UHFFFAOYSA-N`

📖 Product Overview

N-Butyl-N-(4-hydroxybutyl)nitrosamine (CAS: 3817-11-6) is a chemical compound with molecular formula C8H18N2O2 and molecular weight 174.24 g/mol. Its IUPAC systematic name is N-butyl-N-(4-hydroxybutyl)nitrous amide. LogP 1.4 Topological Polar Surface Area 52.9 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 7 Exact Mass 174.13683 Heavy Atoms 12 Complexity 109.0 InChI Key: DIKPQFXYECAYPC-UHFFFAOYSA-N. SMILES: CCCCN(CCCCO)N=O.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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