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| Name |
6-Methoxybenzo(a)pyrene |
EINECS | N/A |
| CAS No. | 52351-96-9 | Density | 1.282g/cm3 |
| PSA | 9.23000 | LogP | 5.74580 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C21H14O | Boiling Point | 498.6°C at 760 mmHg |
| Molecular Weight | 282.35 | Flash Point | 206.4°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Questionable carcinogen with experimental tumorigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
N/A |
6-Methoxybenzo(a)pyrene Chemical Properties
IUPAC Name: 6-methoxybenzo[a]pyrene
Empirical Formula: C21H14O
Molecular Weight: 282.3353g/mol
Structure of 6-Methoxybenzo(a)pyrene (CAS NO.52351-96-9):
.bmp)
Index of Refraction: 1.833
Molar Refractivity: 96.98 cm3
Molar Volume: 220 cm3
Polarizability: 38.44×10-24cm3
Surface Tension: 59 dyne/cm
Density: 1.282 g/cm3
Flash Point: 206.4 °C
Enthalpy of Vaporization: 73.77 kJ/mol
Boiling Point: 498.6 °C at 760 mmHg
Vapour Pressure: 1.38E-09 mmHg at 25°C
Classification Code: Mutation data, Tumor data
Canonical SMILES: COC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C5=CC=CC=C51
InChI: InChI=1S/C21H14O/c1-22-21-17-8-3-2-7-15(17)16-11-9-13-5-4-6-14-10-12-18(21)20(16)19(13)14/h2-12H,1H3
InChIKey: OSXVWSFKNYMAPX-UHFFFAOYSA-N
6-Methoxybenzo(a)pyrene Toxicity Data With Reference
| 1. | mma-sat 18 nmol/plate | BBRCA9 Biochemical and Biophysical Research Communications. 85 (1978),351. | ||
| 2. | skn-mus TDLo:180 mg/kg/40W-I:ETA | CBINA8 Chemico-Biological Interactions. 22 (1)(1978),53. |
6-Methoxybenzo(a)pyrene Safety Profile
Questionable carcinogen with experimental tumorigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes.
6-Methoxybenzo(a)pyrene Specification
6-Methoxybenzo(a)pyrene , its cas register number is 52351-96-9. It also can be called 3-06-00-03810 (Beilstein Handbook Reference) ; BRN 2468269 . When 6-Methoxybenzo(a)pyrene (CAS NO.52351-96-9) is heated to decomposition, it emits acrid smoke and irritating fumes.
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