3-Aminobenzo(a)pyrene

Base Information

• Chemical Name: 3-Aminobenzo(a)pyrene
• CAS No.: 98151-92-9
• Molecular Formula: C20H13N
• Molecular Weight: 267.34
• DSSTox Substance ID: DTXSID20913421
• NCI Thesaurus Code: C29797
• Mol file: 98151-92-9.mol

Synonyms:3-ABaP;3-aminobenzo(a)pyrene

Chemical Property of 3-Aminobenzo(a)pyrene

Chemical Property:

• Vapor Pressure: 2.57E-11mmHg at 25°C
• Boiling Point: 530°Cat760mmHg
• Flash Point: 306°C
• PSA: 26.02000
• Density: 1.347g/cm³
• LogP: 5.90060
• XLogP3: 5.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 267.104799419
• Heavy Atom Count: 21
• Complexity: 405

Purity/Quality:

99% ^*data from raw suppliers

3-AMINOBENZO(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=C2C3=C4C(=CC2=C1)C=CC5=C(C=CC(=C54)C=C3)N