Home Halogens 5-bromo-2,3-dihydrothiophene 1,1-dioxide

5-bromo-2,3-dihydrothiophene 1,1-dioxide

CAS No.:
56879-03-9
Catalog Number:
AG00EC5U
Molecular Formula:
C4H5BrO2S
Molecular Weight:
197.0503
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Product Description
Catalog Number:
AG00EC5U
Chemical Name:
5-bromo-2,3-dihydrothiophene 1,1-dioxide
CAS Number:
56879-03-9
Molecular Formula:
C4H5BrO2S
Molecular Weight:
197.0503
MDL Number:
MFCD00154890
IUPAC Name:
5-bromo-2,3-dihydrothiophene 1,1-dioxide
InChI:
InChI=1S/C4H5BrO2S/c5-4-2-1-3-8(4,6)7/h2H,1,3H2
InChI Key:
IXIQTIKATBUZNM-UHFFFAOYSA-N
SMILES:
BrC1=CCCS1(=O)=O
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.919g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.046g/mol
Monoisotopic Mass:
195.919g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties