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Cas Database |
| Name |
trans-1,2,-Dihydroxy-1,2-dihydro-triphenylene |
EINECS | N/A |
| CAS No. | 68151-04-2 | Density | 1.367g/cm3 |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C18H14 O2 | Boiling Point | 525.2°Cat760mmHg |
| Molecular Weight | 262.308 | Flash Point | 257.2°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 |
N/A |
Article Data | 3 |
trans-1,2,-Dihydroxy-1,2-dihydro-triphenylene Chemical Properties
Molecule structure of trans-1,2,-Dihydroxy-1,2-dihydro-triphenylene (CAS NO.68151-04-2) :
IUPAC Name: (1R,2R)-1,2-dihydrotriphenylene-1,2-diol
Molecular Weight: 262.30256 g/mol
Molecular Formula: C18H14O2
Density: 1.367 g/cm3
Boiling Point: 525.2 °C at 760 mmHg
Flash Point: 257.2 °C
Index of Refraction: 1.793
Molar Refractivity: 81.5 cm3
Molar Volume: 191.7 cm3
Polarizability: 32.31×10-24 cm3
Surface Tension: 65.7 dyne/cm
Enthalpy of Vaporization: 84.14 kJ/mol
Vapour Pressure: 7.35E-12 mmHg at 25 °C
XLogP3-AA: 3.3
H-Bond Donor: 2
H-Bond Acceptor: 2
Exact Mass: 262.09938
MonoIsotopic Mass: 262.09938
Topological Polar Surface Area: 40.5
Heavy Atom Count: 20
Complexity: 391
Defined Atom StereoCenter Count: 2
Canonical SMILES: C1=CC=C2C(=C1)C3=C(C(C(C=C3)O)O)C4=CC=CC=C24
Isomeric SMILES: C1=CC=C2C(=C1)C3=C([C@H]([C@@H](C=C3)O)O)C4=CC=CC=C24
InChI: InChI=1S/C18H14O2/c19-16-10-9-15-13-7-2-1-5-11(13)12-6-3-4-8-14(12)17(15)18(16)20/h1-10,16,18-20H/t16-,18+/m1/s1
InChIKey of trans-1,2,-Dihydroxy-1,2-dihydro-triphenylene (CAS NO.68151-04-2) : BSKBIHOSMNFDAS-AEFFLSMTSA-N
trans-1,2,-Dihydroxy-1,2-dihydro-triphenylene Toxicity Data With Reference
| 1. | mmo-sat 1 nmol/plate | CNREA8 Cancer Research. 40 (1980),1985. | ||
| 2. | mma-sat 1 nmol/plate | CNREA8 Cancer Research. 40 (1980),1985. |
trans-1,2,-Dihydroxy-1,2-dihydro-triphenylene Safety Profile
Mutation data reported. When heated to decomposition it emits acrid smoke and fumes.
trans-1,2,-Dihydroxy-1,2-dihydro-triphenylene Specification
trans-1,2,-Dihydroxy-1,2-dihydro-triphenylene (CAS NO.68151-04-2) is also called 1,2-Dihydro-1,2-triphenylenediol trans- ; 1,2-Triphenylenediol, 1,2-dihydro-, trans- .
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