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996-07-6

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Basic Information
CAS No.: 996-07-6
Name: DI-N-BUTYLMETHYLCHLOROSILANE
Molecular Structure:
Molecular Structure of 996-07-6 (DI-N-BUTYLMETHYLCHLOROSILANE)
Formula: C9H21ClSi
Molecular Weight: 192.804
Synonyms: Dibutylchloromethylsilane;Dibutylmethylchlorosilane;Di-N-butylmethylchlorosilane;
Density: 0.859 g/cm3
Boiling Point: 207.2 °C at 760 mmHg
Flash Point: 77.3 °C
PSA: 0.00000
LogP: 4.40070
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Specification

The CAS register number of Silane,dibutylchloromethyl- is 996-07-6. It also can be called as Di-N-butylmethylchlorosilane and the systematic name about this chemical is dibutyl(chloro)methylsilane. The molecular formula about this chemical is C9H21ClSi and the molecular weight is 192.8.

Physical properties about Silane,dibutylchloromethyl- are: (1)ACD/LogP: 5.36; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.36; (4)ACD/LogD (pH 7.4): 5.36; (5)ACD/BCF (pH 5.5): 7014.97; (6)ACD/BCF (pH 7.4): 7014.97; (7)ACD/KOC (pH 5.5): 19704.99; (8)ACD/KOC (pH 7.4): 19704.99; (9)#Freely Rotating Bonds: 6; (10)Index of Refraction: 1.424; (11)Molar Refractivity: 57.31 cm3; (12)Molar Volume: 224.2 cm3; (13)Polarizability: 22.71x10-24cm3; (14)Surface Tension: 22.4 dyne/cm; (15)Density: 0.859 g/cm3; (16)Flash Point: 77.3 °C; (17)Enthalpy of Vaporization: 42.53 kJ/mol; (18)Boiling Point: 207.2 °C at 760 mmHg; (19)Vapour Pressure: 0.329 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl[Si](CCCC)(CCCC)C
(2)InChI: InChI=1/C9H21ClSi/c1-4-6-8-11(3,10)9-7-5-2/h4-9H2,1-3H3
(3)InChIKey: BWRNKYALSQGWSW-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C9H21ClSi/c1-4-6-8-11(3,10)9-7-5-2/h4-9H2,1-3H3
(5)Std. InChIKey: BWRNKYALSQGWSW-UHFFFAOYSA-N