-
Name
3-aminobenzo(a)pyrene
- EINECS
- CAS No. 98151-92-9
- Density 1.347g/cm3
- Solubility
- Melting Point
- Formula C20H13N
- Boiling Point 530°Cat760mmHg
- Molecular Weight 267.34
- Flash Point 306°C
- Transport Information
- Appearance
- Safety Mutation data reported. When heated to decomposition it emits toxic vapors of NOx.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 3-AMINOBENZO(A)PYRENE;BENZO(A)PYREN-3-AMINE;3-Aminobenzo[a]pyrene;
- PSA 26.02000
- LogP 5.90060
Benzo(a)pyren-3-amine Chemical Properties
Product Name: Benzo(a)pyren-3-amine (CAS NO.98151-92-9)
Molecular Formula: C20H13N
Molecular Weight: 267.34g/mol
Mol File: 98151-92-9.mol
Boiling point: 530 °C at 760 mmHg
Flash Point: 306 °C
Density: 1.347 g/cm3
Surface Tension: 72.7 dyne/cm
Enthalpy of Vaporization: 80.52 kJ/mol
Vapour Pressure: 2.57E-11 mmHg at 25°C
XLogP3-AA: 5.6
H-Bond Donor: 1
H-Bond Acceptor: 1
Structure Descriptors of Benzo(a)pyren-3-amine (CAS NO.98151-92-9):
IUPAC Name: benzo[a]pyren-3-amine
Canonical SMILES: C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C(C=CC(=C54)C=C3)N
InChI: InChI=1S/C20H13N/c21-18-10-7-12-5-8-16-15-4-2-1-3-13(15)11-14-6-9-17(18)
19(12)20(14)16/h1-11H,21H2
InChIKey: QBWLAIGPKULPQC-UHFFFAOYSA-N
Benzo(a)pyren-3-amine Toxicity Data With Reference
| 1. | mic-sat 100 ng/plate | CRNGDP Carcinogenesis. 6 (1985),1235. |
Benzo(a)pyren-3-amine Safety Profile
Mutation data reported. When heated to decomposition it emits toxic vapors of NOx.
Benzo(a)pyren-3-amine Specification
Benzo(a)pyren-3-amine ,its CAS NO. is 98151-92-9,the synonyms is 3-Aminobenzo(a)pyrene ; CCRIS 7464 .
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