-
Name
tetrangomycin
- EINECS
- CAS No. 7351-08-8
- Article Data6
- CAS DataBase
- Density 1.49g/cm3
- Solubility
- Melting Point 183°C
- Formula C19H14O5
- Boiling Point 615.2°Cat760mmHg
- Molecular Weight 322.317
- Flash Point 339.9°C
- Transport Information
- Appearance
- Safety Poison by ingestion, subcutaneous, and intraperitoneal routes. When heated to decomposition it emits acrid smoke and irritating fumes.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 3,8-dihydroxy-3-methyl-3,4-dihydrotetraphene-1,7,12(2H)-trione;Benz(a)anthracene-1,7,12(2H)-trione,3,4-dihydro-3,8-dihydroxy-3-methyl-,(+);3,8-dihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione;(+)-3,4-Dihydro-3,8-dihydroxy-3-methylbenz(a)anthracene-1,7,12(2H)-trione;
- PSA 91.67000
- LogP 2.04750
Tetrangomycin Chemical Properties
IUPAC Name of Tetrangomycin (CAS NO.7351-08-8): 3,8-dihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione
Molecular Weight: 322.31146 g/mol
Molecular Formula: C19H14O5
Density: 1.49 g/cm3
Boiling Point: 615.2 °C at 760 mmHg
Flash Point: 339.9 °C
Index of Refraction: 1.701
Molar Refractivity: 83.67 cm3
Molar Volume: 216.2 cm3
Polarizability: 33.16×10-24cm3
Surface Tension: 74.7 dyne/cm
Enthalpy of Vaporization: 95.95 kJ/mol
XLogP3-AA: 2.4
H-Bond Donor: 2
H-Bond Acceptor: 5
Tautomer Count: 10
MonoIsotopic Mass: 322.084124
Topological Polar Surface Area: 91.7
Heavy Atom Count: 24
Complexity: 599
InChI: InChI=1S/C19H14O5/c1-19(24)7-9-5-6-11-16(14(9)13(21)8-19)18(23)10-3-2-4-12(20)15(10)17(11)22/h2-6,20,24H,7-8H2,1H3
InChIKey: UGEKKXLEYACFTD-UHFFFAOYSA-N
Synonyms of Tetrangomycin (CAS NO.7351-08-8): (+)-3,4-Dihydro-3,8-dihydroxy-3-methylbenz[a]anthracene-1,7,12(2H)-trione
Tetrangomycin Toxicity Data With Reference
| 1. | orl-mus LD50:221 mg/kg | 85GDA2 CRC Handbook of Antibiotic Compounds, Volumes 1-9. 3 (1980),181. | ||
| 2. | ipr-mus LD50:41 mg/kg | 85GDA2 CRC Handbook of Antibiotic Compounds, Volumes 1-9. 3 (1980),181. | ||
| 3. | scu-mus LD50:147 mg/kg | 85GDA2 CRC Handbook of Antibiotic Compounds, Volumes 1-9. 3 (1980),181. |
Tetrangomycin Safety Profile
Poison by ingestion, subcutaneous, and intraperitoneal routes. When heated to decomposition it emits acrid smoke and irritating fumes.
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