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1625-80-5 | [3,3'-Bipyridine]-5-sulfonic acid
CAS No: 1625-80-5 Catalog No: AG001T72 MDL No:
Product Description
Catalog Number:
AG001T72
Chemical Name:
[3,3'-Bipyridine]-5-sulfonic acid
CAS Number:
1625-80-5
Molecular Formula:
C10H8N2O3S
Molecular Weight:
236.2471
IUPAC Name:
5-pyridin-3-ylpyridine-3-sulfonic acid
InChI:
InChI=1S/C10H8N2O3S/c13-16(14,15)10-4-9(6-12-7-10)8-2-1-3-11-5-8/h1-7H,(H,13,14,15)
InChI Key:
TXRQSUPFWXZJTF-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)c1cncc(c1)c1cccnc1
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.026g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.245g/mol
Monoisotopic Mass:
236.026g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
88.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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