Home Halogens 3-bromothietane 1,1-dioxide

3-bromothietane 1,1-dioxide

CAS No.:
59463-72-8
Catalog Number:
AG00ECOZ
Molecular Formula:
C3H5BrO2S
Molecular Weight:
185.0396
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Product Description
Catalog Number:
AG00ECOZ
Chemical Name:
3-bromothietane 1,1-dioxide
CAS Number:
59463-72-8
Molecular Formula:
C3H5BrO2S
Molecular Weight:
185.0396
MDL Number:
MFCD11870754
IUPAC Name:
3-bromothietane 1,1-dioxide
InChI:
InChI=1S/C3H5BrO2S/c4-3-1-7(5,6)2-3/h3H,1-2H2
InChI Key:
XSEKMFLQQOEVTJ-UHFFFAOYSA-N
SMILES:
BrC1CS(=O)(=O)C1
NSC Number:
187745
Properties
Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.919g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.035g/mol
Monoisotopic Mass:
183.919g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties