N-ethyl-N-(pyridin-4-ylmethyl)nitrous amide

Base Information

• Chemical Name: N-ethyl-N-(pyridin-4-ylmethyl)nitrous amide
• CAS No.: 13256-23-0
• Molecular Formula: C8H11N3O
• Molecular Weight: 165.22
• DSSTox Substance ID: DTXSID80927721
• Nikkaji Number: J35.408B
• Wikidata: Q82902367
• ChEMBL ID: CHEMBL168052
• Mol file: 13256-23-0.mol

Synonyms:13256-23-0;Aethyl-4-picolylnitrosamin [German];N-ethyl-N-(pyridin-4-ylmethyl)nitrous amide;N-Nitroso-4-picolylethylamine;4-((Ethylnitrosamino)methyl)pyridine;Aethyl-4-picolylnitrosamin;Pyridine, 4-((ethylnitrosamino)methyl)-;N-Ethyl-N-nitroso-4-pyridinemethanamine;Pyridine, 4-[(ethylnitrosamino)methyl]-;4-pyridinemethanamine, n-ethyl-n-nitroso-;CHEMBL168052;DTXSID80927721;4-[(Ethylnitrosoamino)methyl]pyridine;LS-131601;N-Ethyl-N-[(pyridin-4-yl)methyl]nitrous amide

Chemical Property of N-ethyl-N-(pyridin-4-ylmethyl)nitrous amide

Chemical Property:

• Vapor Pressure: 0.000104mmHg at 25°C
• Refractive Index: 1.7400 (estimate)
• Boiling Point: 348°C at 760 mmHg
• PKA: 5.70±0.10(Predicted)
• Flash Point: 164.3°C
• PSA: 45.56000
• Density: 1.1g/cm³
• LogP: 1.58490
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 165.090211983
• Heavy Atom Count: 12
• Complexity: 134

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC1=CC=NC=C1)N=O