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| Name |
12-Methyl-7-Propylbenz(A)Anthracene |
EINECS | N/A |
| CAS No. | 16354-54-4 | Density | 1.104g/cm3 |
| PSA | 0.00000 | LogP | 6.40710 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C22H20 | Boiling Point | 480.5°Cat760mmHg |
| Molecular Weight | 284.401 | Flash Point | 239.6°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Questionable carcinogen with experimental neoplastigenic data. When heated to decomposition it emits acrid smoke and irritating fumes. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Benz(a)anthracene,12-methyl-7-propyl;12-Methyl-7-propylbenz(a)anthracene; |
12-Methyl-7-Propylbenz(A)Anthracene Chemical Properties
Chemistry informtion about 12-Methyl-7-Propylbenz(A)Anthracene(CAS NO.16354-54-4) is:
IUPAC Name: 12-methyl-7-propylbenzo[b]phenanthrene
Synonyms: 12-Methyl-7-propylbenz(a)anthracene ; 4-05-00-02603 (Beilstein Handbook Reference) ; BRN 3317615
Systematic Name: Benz(a)anthracene, 12-methyl-7-propyl-
Molecular Weight: 284.3942 [g/mol]
Molecular Formula: C22H20
XLogP3: 6.8
Density: 1.104 g/cm3
Flash Point: 239.6 °C
Enthalpy of Vaporization: 71.66 kJ/mol
Boiling Point: 480.5 °C at 760 mmHg
Vapour Pressure: 6.3E-09 mmHg at 25°C
Following is the molecular structure of 12-Methyl-7-Propylbenz(A)Anthracene(CAS NO.16354-54-4) is:
12-Methyl-7-Propylbenz(A)Anthracene Toxicity Data With Reference
| 1. | ims-rat TDLo:50 mg/kg:NEO | PNASA6 Proceedings of the National Academy of Sciences of the United States of America. 58 (1967),2253. |
12-Methyl-7-Propylbenz(A)Anthracene Safety Profile
Questionable carcinogen with experimental neoplastigenic data. When heated to decomposition it emits acrid smoke and irritating fumes.
12-Methyl-7-Propylbenz(A)Anthracene Specification
Descriptors Computed from Structure about 12-Methyl-7-Propylbenz(A)Anthracene(CAS NO.16354-54-4) is:
IUPAC Name: 12-methyl-7-propylbenzo[b]phenanthrene
Canonical SMILES: CCCC1=C2C=CC3=CC=CC=C3C2=C(C4=CC=CC=C41)C
InChI: InChI=1S/C22H20/c1-3-8-19-20-12-7-6-10-17(20)15(2)22-18-11-5-4-9-16(18)13-14-21(19)22/h4-7,9-14H,3,8H2,1-2H3
InChIKey: YQKGLNLJXKJWSN-UHFFFAOYSA-N
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