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CAS No.: | 21248-01-1 |
---|---|
Name: | 6-CHLOROBENZO(A)PYRENE |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C20H11 Cl |
Molecular Weight: | 286.69 |
Synonyms: | 6-Chlorobenzo[a]pyrene |
Density: | 1.378g/cm3 |
Melting Point: | 209.5°C |
Boiling Point: | 495°C at 760 mmHg |
Flash Point: | 243.7°C |
Safety: | Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits toxic fumes of Cl−. See also CHLORINATED HYDROCARBONS, AROMATIC; and PYRENE. |
PSA: | 0.00000 |
LogP: | 6.39060 |
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IUPAC Name: 6-chlorobenzo[a]pyrene
Empirical Formula: C20H11Cl
Molecular Weight: 286.7543g/mol
Structure of 6-Chlorobenzeno(a)pyrene (CAS NO.21248-01-1):
Index of Refraction: 1.879
Molar Refractivity: 95.2 cm3
Molar Volume: 208 cm3
Polarizability: 37.74×10-24cm3
Surface Tension: 64.4 dyne/cm
Density: 1.378 g/cm3
Flash Point: 243.7 °C
Enthalpy of Vaporization: 73.35 kJ/mol
Boiling Point: 495 °C at 760 mmHg
Vapour Pressure: 1.87E-09 mmHg at 25°C
Classification Code: Tumor data
Canonical SMILES: C1=CC=C2C(=C1)C3=C4C(=C2Cl)C=CC5=CC=CC(=C54)C=C3
InChI: InChI=1S/C20H11Cl/c21-20-16-7-2-1-6-14(16)15-10-8-12-4-3-5-13-9-11-17(20)19(15)18(12)13/h1-11H
InChIKey: YBIBTKJSLUJSSJ-UHFFFAOYSA-N
Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits toxic fumes of Cl−. See also CHLORINATED HYDROCARBONS, AROMATIC; and PYRENE.
6-Chlorobenzeno(a)pyrene , its cas register number is 21248-01-1. It also can be called 3-05-00-02520 (Beilstein Handbook Reference) ; 6-Chlorobenzo(a)pyrene ; BRN 2464084 . When heated to decomposition it emits toxic fumes of Cl−. And the storage environment of 6-Chlorobenzeno(a)pyrene (CAS NO.21248-01-1) should be ventilate, low-temperature and dry.