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98626-92-7 | 2-broMo-6-(Methylsulfonyl)pyridine
CAS No: 98626-92-7 Catalog No: AG01F08P MDL No:
Product Description
Catalog Number:
AG01F08P
Chemical Name:
2-broMo-6-(Methylsulfonyl)pyridine
CAS Number:
98626-92-7
Molecular Formula:
C6H6BrNO2S
Molecular Weight:
236.0863
IUPAC Name:
2-bromo-6-methylsulfonylpyridine
InChI:
InChI=1S/C6H6BrNO2S/c1-11(9,10)6-4-2-3-5(7)8-6/h2-4H,1H3
InChI Key:
DOSBGYNVIALPBI-UHFFFAOYSA-N
SMILES:
Brc1cccc(n1)S(=O)(=O)C
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.93g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.083g/mol
Monoisotopic Mass:
234.93g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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