6-Nitrosobenzo(a)pyrene

Base Information

• Chemical Name: 6-Nitrosobenzo(a)pyrene
• CAS No.: 118745-15-6
• Molecular Formula: C20H11 N O
• Molecular Weight: 0
• UNII: 1HJS99HR9S
• DSSTox Substance ID: DTXSID70152227
• Nikkaji Number: J929.895I
• Wikidata: Q83018849
• Mol file: 118745-15-6.mol

Synonyms:6-nitrosobenzo(a)pyrene;6-NO-BaP

Chemical Property of 6-Nitrosobenzo(a)pyrene

Chemical Property:

• Vapor Pressure: 1.53E-10mmHg at 25°C
• Boiling Point: 523.8°Cat760mmHg
• Flash Point: 214.4°C
• PSA: 29.43000
• Density: 1.31g/cm³
• LogP: 6.13510
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 281.084063974
• Heavy Atom Count: 22
• Complexity: 449

Purity/Quality:

6-NITROSOBENZO(A)PYRENE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C3=C4C(=C2N=O)C=CC5=CC=CC(=C54)C=C3