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Cas Database |
| Name |
7-Hydroxymethyl-12-methylbenz(a)anthracene |
EINECS | N/A |
| CAS No. | 568-75-2 | Density | 1.227g/cm3 |
| PSA | 20.23000 | LogP | 4.94690 |
| Solubility | N/A | Melting Point |
162-163 °C |
| Formula | C20H16 O | Boiling Point | 523.8°C at 760 mmHg |
| Molecular Weight | 272.36 | Flash Point | 225.9°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by intravenous route. Experimental teratogenic and reproductive effects. Questionable carcinogen with experimental carcinogenic, neoplastigenic, and tumorigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and fumes. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
7-(Hydroxymethyl)-12-methylbenz[a]anthracene |
Article Data | 5 |
7-Hydroxymethyl-12-methylbenz(a)anthracene Chemical Properties
Product Name: 7-Hydroxymethyl-12-methylbenz(a)anthracene (CAS NO.568-75-2)
Molecular Formula: C20H16O
Molecular Weight: 272.36g/mol
Mol File: 568-75-2.mol
Boiling point: 523.8 °C at 760 mmHg
Storage Temperature:
Flash Point: 225.9 °C
Density: 1.227 g/cm3
Surface Tension: 57.1 dyne/cm
Enthalpy of Vaporization: 83.96 kJ/mol
Vapour Pressure: 8.45E-12 mmHg at 25°C
XLogP3-AA: 4.5
H-Bond Donor: 1
H-Bond Acceptor: 1
IUPAC Name: (12-methylbenzo[b]phenanthren-7-yl)methanol
Canonical SMILES: CC1=C2C(=C(C3=CC=CC=C13)CO)C=CC4=CC=CC=C42
InChI: InChI=1S/C20H16O/c1-13-15-7-4-5-9-17(15)19(12-21)18-11-10-14-6-2-3-8-16
(14)20(13)18/h2-11,21H,12H2,1H3
InChIKey: JCBBZYDVQJQMMB-UHFFFAOYSA-N
7-Hydroxymethyl-12-methylbenz(a)anthracene Toxicity Data With Reference
| 1. | dnd-rat-ipr 100 µmol/kg | CRNGDP Carcinogenesis. 3 (1982),297. | ||
| 2. | dnd-mus-skn 16 µmol/kg | CNREA8 Cancer Research. 43 (1983),4221. | ||
| 3. | ivn-rat LD50:73 mg/kg | KIDZAK Kansai Ika Daigaku Zasshi. Journal of the Kansai Medical School. 23 (Suppl 1)(1971),35. |
7-Hydroxymethyl-12-methylbenz(a)anthracene Consensus Reports
EPA Genetic Toxicology Program.
7-Hydroxymethyl-12-methylbenz(a)anthracene Safety Profile
Poison by intravenous route. Experimental teratogenic and reproductive effects. Questionable carcinogen with experimental carcinogenic, neoplastigenic, and tumorigenic data. Mutation data reported. When heated to decomposition it emits acrid smoke and fumes.
7-Hydroxymethyl-12-methylbenz(a)anthracene Specification
7-Hydroxymethyl-12-methylbenz(a)anthracene ,its CAS NO. is 568-75-2,the synonyms is (12-methylbenzo[b]phenanthren-7-yl)methanol ; 12-Methylbenz(a)anthracene-7-methanol ; Benz(a)anthracene-7-methanol, 12-methyl- .
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