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Molecule structure of Dicumylmethane (CAS NO.25566-92-1):
IUPAC Name: 1-Propan-2-yl-4-[(4-propan-2-ylphenyl)methyl]benzene
Molecular Weight: 252.39386 g/mol
Molecular Formula: C19H24
Density: 0.938 g/cm3
Boiling Point: 346.1 °C at 760 mmHg
Flash Point: 173.8 °C
Index of Refraction: 1.536
Molar Refractivity: 83.93 cm3
Molar Volume: 268.9 cm3
Polarizability: 33.27×10-24 cm3
Surface Tension: 33.7 dyne/cm
Enthalpy of Vaporization: 56.7 kJ/mol
Vapour Pressure: 0.000117 mmHg at 25 °C
XLogP3-AA: 6.1
Rotatable Bond Count: 4
Exact Mass: 252.187801
MonoIsotopic Mass: 252.187801
Complexity: 211
Canonical SMILES: CC(C)C1=CC=C(C=C1)CC2=CC=C(C=C2)C(C)C
InChI: InChI=1S/C19H24/c1-14(2)18-9-5-16(6-10-18)13-17-7-11-19(12-8-17)15(3)4/h5-12,14-15H,13H2,1-4H3
InChIKey of Dicumylmethane (CAS NO.25566-92-1): GAVRKMGLLRRNRS-UHFFFAOYSA-N
1. | orl-mus LDLo:15 g/kg | TPKVAL Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Sciences. 6 (1964),73. | ||
2. | ihl-mus LCLo:122 mg/m3 | TPKVAL Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Sciences. 6 (1964),73. | ||
3. | scu-mus LDLo:19 g/kg | TPKVAL Toksikologiya Novykh Promyshlennykh Khimicheskikh Veshchestv. Toxicology of New Industrial Chemical Sciences. 6 (1964),73. |
Poison by inhalation. Mildly toxic by ingestion and subcutaneous routes. When heated to decomposition it emits acrid smoke and irritating fumes.
Dicumylmethane (CAS NO.25566-92-1) is also named as Benzene, 1,1'-methylenebis((1-methylethyl)- ; DKM ; DKM [Russian] ; Diisopropyldiphenylmethane ; Methane, dicumenyl- .