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Search term: ZDMPNSCONYDOCM-FYAZGKSFAG
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Inherent Properties, Identifiers and References
ChemSpider ID: 109980
Empirical Formula: C9H14Pb
Molecular Weight: 329.4075
Nominal Mass: 330 Da
Average Mass: 329.4075 Da
Monoisotopic Mass: 330.08615 Da
Systematic Name: trimethyl-phenyl-plumbane
SMILES: c1cc(ccc1)[Pb](C)(C)C
InChI: InChI=1/C6H5.3CH3.Pb/c1-2-4-6-5-3-1;;;;/h1-5H;3*1H3;/rC9H14Pb/c1-​10(2,3)9-7-5-4-6-8-9/h4-8H,1-3H3
InChIKey: ZDMPNSCONYDOCM-FYAZGKSFAG
Std. InChI: InChI=1S/C6H5.3CH3.Pb/c1-2-4-6-5-3-1;;;;/h1-5H;3*1H3;
Std. InChIKey: ZDMPNSCONYDOCM-UHFFFAOYSA-N
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19040-53-0 [RN]

Plumbane,​trimethyl​phenyl-

ACD/LogP: 4.73 # of Rule of 5 Violations: 0
ACD/LogD (pH 5.5): 4.73 ACD/LogD (pH 7.4): 4.73
ACD/BCF (pH 5.5): 2310.63 ACD/BCF (pH 7.4): 2310.63
ACD/KOC (pH 5.5): 8899.28 ACD/KOC (pH 7.4): 8899.28
#H bond acceptors: 0 #H bond donors: 0
#Freely Rotating Bonds: 1 Polar Surface Area: 0 Å2
Index of Refraction: Molar Refractivity: cm3
Molar Volume: cm3 Polarizability: 10-24cm3
Surface Tension: dyne/cm Density: g/cm3
Flash Point: 98.8 °C Enthalpy of Vaporization: 45.73 kJ/mol
Boiling Point: 239.7 °C at 760 mmHg Vapour Pressure: 0.061 mmHg at 25°C