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100516-82-3 | Thiophene, 2,3-dibromotetrahydro-2-methyl-, 1,1-dioxide
CAS No: 100516-82-3 Catalog No: AG00027F MDL No:
Product Description
Catalog Number:
AG00027F
Chemical Name:
Thiophene, 2,3-dibromotetrahydro-2-methyl-, 1,1-dioxide
CAS Number:
100516-82-3
Molecular Formula:
C5H8Br2O2S
Molecular Weight:
291.9888
IUPAC Name:
2,3-dibromo-2-methylthiolane 1,1-dioxide
InChI:
InChI=1S/C5H8Br2O2S/c1-5(7)4(6)2-3-10(5,8)9/h4H,2-3H2,1H3
InChI Key:
OTEBCSOFUNDJLU-UHFFFAOYSA-N
SMILES:
BrC1CCS(=O)(=O)C1(C)Br
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.859g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.985g/mol
Monoisotopic Mass:
289.861g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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