3-(Chloromethyl)benzo(a)pyrene

Base Information

• Chemical Name: 3-(Chloromethyl)benzo(a)pyrene
• CAS No.: 123358-37-2
• Molecular Formula: C21H13 Cl
• Molecular Weight: 300.7809
• DSSTox Substance ID: DTXSID20153986
• Wikidata: Q83021062

Synonyms:3-(Chloromethyl)benzo(a)pyrene;Benzo(a)pyrene, 3-(chloromethyl)-;3-(chloromethyl)benzo[a]pyrene;123358-37-2;DTXSID20153986

Chemical Property of 3-(Chloromethyl)benzo(a)pyrene

Chemical Property:

• Vapor Pressure: 1.81E-10mmHg at 25°C
• Boiling Point: 521.9°Cat760mmHg
• Flash Point: 243.6°C
• Density: 1.344g/cm³
• XLogP3: 6.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 300.0705781
• Heavy Atom Count: 22
• Complexity: 418

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C(C=CC(=C54)C=C3)CCl

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