The Propane, 1, 2-dibromo-1-chloro-, with the CAS registry number 32595-09-8, is also known as 1, 2-Dibromochloropropane. Its EINECS registry number is 251-120-7. This chemical's molecular formula is C3H5Br2Cl and molecular weight is 236.33. What's more, its IUPAC name is 1, 2-Dibromo-1-chloropropane.
Physical properties about Propane, 1, 2-dibromo-1-chloro- are: (1)ACD/LogP: 2.75; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.75; (4)ACD/LogD (pH 7.4): 2.75; (5)ACD/BCF (pH 5.5): 72.98; (6)ACD/BCF (pH 7.4): 72.98; (7)ACD/KOC (pH 5.5): 750.43; (8)ACD/KOC (pH 7.4): 750.43; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.533; (14)Molar Refractivity: 36.17 cm3; (15)Molar Volume: 116.5 cm3; (16)Polarizability: 14.34×10-24 cm3; (17)Surface Tension: 37.7 dyne/cm; (18)Density: 2.027 g/cm3; (19)Flash Point: 66.4 °C; (20)Enthalpy of Vaporization: 38.81 kJ/mol; (21)Boiling Point: 168.3 °C at 760 mmHg; (22)Vapour Pressure: 2.15 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: BrC(C)C(Br)Cl
(2) InChI: InChI=1/C3H5Br2Cl/c1-2(4)3(5)6/h2-3H,1H3
(3) InChIKey: XWACZKSYLJCQIJ-UHFFFAOYAI
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