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| CAS No.: | 63041-56-5 |
|---|---|
| Name: | 7,14-Dihydro-7,14-dipropyldibenz[a,h]anthracene-7,14-diol |
| Molecular Structure: | |
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| Formula: | C28H28O2 |
| Molecular Weight: | 396.56 |
| Density: | 1.189g/cm3 |
| Boiling Point: | 617.1°C at 760 mmHg |
| Flash Point: | 274.9°C |
| Safety: | Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits acrid smoke and irritating fumes. |
| PSA: | 40.46000 |
| LogP: | 6.37840 |
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Chemistry
IUPAC Name: 7,14-Dipropylnaphtho[1,2-b]phenanthrene-7,14-diol
Synonyms of 7,14-Dihydro-7,14-dipropyldibenz(a,h)anthracene-7,14-diol (CAS NO.63041-56-5): 9,10-Di-n-propyl-9-10-dihydroxy-9,10-dihydro-1,2,5,6-dibenzanthracene ; 9,10-Dihydro-9,10-dihydroxy-9,10-di-n-propyl-1,2:5,6-dibenzanthracene ; 9,10-Dihydroxy-9,10-di-n-propyl-9,10-dihydro-1,2:5,6-dibenzanthracene ; Dibenz(a,h)anthracene-7,14-diol, 7,14-dihydro-7,14-dipropyl-
CAS NO: 63041-56-5
Molecular Formula: C28H28O2
Molecular Weight: 396.5207
Molecular Structure : .png)
H bond acceptors: 2
H bond donors: 2
Freely Rotating Bonds: 6
Polar Surface Area: 18.46 Å2
Index of Refraction: 1.673
Molar Refractivity: 125 cm3
Molar Volume: 333.2 cm3
Surface Tension: 54.2 dyne/cm
Density: 1.189 g/cm3
Flash Point: 274.9 °C
Enthalpy of Vaporization: 96.22 kJ/mol
Boiling Point: 617.1 °C at 760 mmHg
Vapour Pressure: 4.35E-16 mmHg at 25°C
InChI: InChI=1/C28H28O2/c1-3-17-27(29)23-15-13-20-10-6-8-12-22(20)26(23)28(30,18-4-2)24-16-14-19-9-5-7-11-21(19)25(24)27/h5-16,29-30H,3-4,17-18H2,1-2H3
InChIKey: FRQSMRFSNSDREC-UHFFFAOYAC
Std. InChI: InChI=1S/C28H28O2/c1-3-17-27(29)23-15-13-20-10-6-8-12-22(20)26(23)28(30,18-4-2)24-16-14-19-9-5-7-11-21(19)25(24)27/h5-16,29-30H,3-4,17-18H2,1-2H3
Std. InChIKey: FRQSMRFSNSDREC-UHFFFAOYSA-N
Safety Profile
Questionable carcinogen with experimental tumorigenic data. When 7,14-Dihydro-7,14-dipropyldibenz(a,h)anthracene-7,14-diol (CAS NO.63041-56-5) is heated to decomposition, it emits acrid smoke and irritating fumes.