N-Nitrosodiisobutylamine (C8H18N2O)

N-Nitrosodiisobutylamine presents a C8 framework, basic nitrogen (formula C8H18N2O, CAS 997-95-5). ChemicalTool Reaction can propose ranked disconnections for N-Nitrosodiisobutylamine from the SMILES CC(C)CN(CC(C)C)N=O.

Target: N-Nitrosodiisobutylamine
CAS: 997-95-5
Formula: C8H18N2O
Approx. MW: 158.25
SMILES: CC(C)CN(CC(C)C)N=O
PubChem CID: 13829
Approx. carbons: C8

N-Nitrosodiisobutylamine structure

Properties

IUPAC name: N,N-bis(2-methylpropyl)nitrous amide
Common names: N-Nitrosodiisobutylamine; 997-95-5; Dmdpn; Diisobutylnitrosamine; Diisobutylnitrosoamine; N,N-Diisobutylnitrosamine; Nitrosodiisobutylamine; Diisobutylamine, N-nitroso-; 2,2'-Dimethyldipropylnitrosoamine; Di-iso-butylnitrosamine
Molecular weight: 158.24
Exact mass: 158.14
InChIKey: XLZCLFRMPCBSDI-UHFFFAOYSA-N

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N-Nitrosodiisobutylamine 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of N-Nitrosodiisobutylamine?

N-Nitrosodiisobutylamine has molecular formula C8H18N2O. Molecular weight about 158.25 g·mol⁻¹.

What is the CAS number of N-Nitrosodiisobutylamine?

The CAS Registry Number for N-Nitrosodiisobutylamine is 997-95-5.

Run AI retrosynthesis for N-Nitrosodiisobutylamine Target catalog AI tools overview

Start from this SMILES and explore AI retrosynthesis routes for C8H18N2O.

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References & tools

ChemicalTool Reaction — AI retrosynthesis with optional library evidence.
PubChem — compound identifiers and structure depictions (NIH/NCBI).
Related: AiZynthFinder / synthesis planning literature for computer-aided retrosynthesis.