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Thietane, 3-bromo-,1,1-dioxide (59463-72-8)

Identification
Name:Thietane, 3-bromo-,1,1-dioxide
Synonyms:3-Bromo-l6-thietane 1,1-dioxide;3-Bromothietane 1,1-dioxide;NSC 187745;
CAS:59463-72-8
Molecular Formula: C3H5BrO2S
Molecular Weight: 0
InChI: InChI=1S/C3H5BrO2S/c4-3-1-7(5,6)2-3/h3H,1-2H2
Molecular Structure: (C3H5BrO2S) 3-Bromo-l6-thietane 1,1-dioxide;3-Bromothietane 1,1-dioxide;NSC 187745;
Properties
Density:2.013 g/cm3
Specification:

The cas register number of 3-Bromothietane-1,1-dioxide is 59463-72-8. It also can be called as Thietane, 3-bromo-,1,1-dioxide and the Systematic name about this chemical is 3-bromothietane 1,1-dioxide.

Physical properties about 3-Bromothietane-1,1-dioxide are: (1)ACD/LogP: -0.68; (2)#H bond acceptors: 2; (3)Polar Surface Area: 42.52Å2; (4)Index of Refraction: 1.575; (5)Molar Refractivity: 30.41 cm3; (6)Molar Volume: 91.9 cm3; (7)Polarizability: 12.05x10-24cm3; (8)Surface Tension: 55.5 dyne/cm; (9)Enthalpy of Vaporization: 57.8 kJ/mol; (10)Boiling Point: 356.5 °C at 760 mmHg; (11)Vapour Pressure: 5.98E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: BrC1CS(=O)(=O)C1
(2)InChI: InChI=1/C3H5BrO2S/c4-3-1-7(5,6)2-3/h3H,1-2H2
(3)InChIKey: XSEKMFLQQOEVTJ-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C3H5BrO2S/c4-3-1-7(5,6)2-3/h3H,1-2H2
(5)Std. InChIKey: XSEKMFLQQOEVTJ-UHFFFAOYSA-N

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