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| Name |
cis-2a,3-Dihydroxy-3-methyl-cholanthrene |
EINECS | N/A |
| CAS No. | 68688-84-6 | Density | 1.381g/cm3 |
| PSA | 40.46000 | LogP | 3.90460 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C21H18O2 | Boiling Point | 526.1°Cat760mmHg |
| Molecular Weight | 302.3664 | Flash Point | 250.1°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Mutation data reported. When heated to decomposition it emits acrid smoke and fumes. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
3-Methylcholanthrene-cis-2a,3-diol;cis-2a,3-Dihydroxy-3-methylcholanthrene;2,3-Dihydroxy-3-methylcholanthrene; |
cis-2a,3-Dihydroxy-3-methyl-cholanthrene Chemical Properties
IUPAC Name: (2aS,3R)-3-methyl-1,2-dihydrobenzo[j]aceanthrylene-2a,3-diol
Synonyms of cis-2a,3-Dihydroxy-3-methyl-cholanthrene (CAS NO.68688-84-6): 3-Methylcholanthrene-cis-2a,3-diol ; 2,3-Dihydroxy-3-methylcholanthrene ; Benz(j)aceanthrylene-2a,3(3H)-diol, 1,2-dihydro-3-methyl-, (Z)- ; cis-2-alpha,3-Dihydrodihydroxy-3-methylcholanthrene ; Benz(j)aceanthrylene-2a,3(3H)-diol, 1,2-dihydro-3-methyl-, cis- ; Cholanthrene-2a,3-diol, 2a,3-dihydro-3-methyl-, (Z)- ; cis-1,2-Dihydro-3-methylbenz(j)aceanthrylene-2a,3(3H)-diol
CAS NO: 68688-84-6
Molecular Formula of cis-2a,3-Dihydroxy-3-methyl-cholanthrene (CAS NO.68688-84-6): C21H18O2
Molecular Weight: 302.3664
Molecular Structure:
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H bond acceptors: 2
H bond donors: 2
Freely Rotating Bonds: 2
Polar Surface Area: 18.46 Å2
Index of Refraction: 1.798
Molar Refractivity: 93.44 cm3
Molar Volume: 218.8 cm3
Surface Tension: 73.2 dyne/cm
Density of cis-2a,3-Dihydroxy-3-methyl-cholanthrene (CAS NO.68688-84-6): 1.381 g/cm3
Flash Point: 250.1 °C
Enthalpy of Vaporization: 84.25 kJ/mol
Boiling Point: 526.1 °C at 760 mmHg
Vapour Pressure: 6.78E-12 mmHg at 25°C
cis-2a,3-Dihydroxy-3-methyl-cholanthrene Toxicity Data With Reference
| 1. | mma-sat 20 µmol/L | BBRCA9 Biochemical and Biophysical Research Communications. 85 (1978),1568. | ||
| 2. | otr-mus:fbr 1 mg/L | BBRCA9 Biochemical and Biophysical Research Communications. 85 (1978),1568. | ||
| 3. | msc-ham:lng 1 mg/L | BBRCA9 Biochemical and Biophysical Research Communications. 85 (1978),1568. |
cis-2a,3-Dihydroxy-3-methyl-cholanthrene Consensus Reports
EPA Genetic Toxicology Program.
cis-2a,3-Dihydroxy-3-methyl-cholanthrene Safety Profile
Mutation data reported. When heated to decomposition it emits acrid smoke and fumes.
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