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Home > Pyridines > 1314921-23-7
1314921-23-7 | 1H-pyrazolo[3,4-b]pyridine-3-sulfonyl chloride
CAS No: 1314921-23-7 Catalog No: AG01AJ0R MDL No:MFCD19201233
Product Description
Catalog Number:
AG01AJ0R
Chemical Name:
1H-pyrazolo[3,4-b]pyridine-3-sulfonyl chloride
CAS Number:
1314921-23-7
Molecular Formula:
C6H4ClN3O2S
Molecular Weight:
217.6329
MDL Number:
MFCD19201233
IUPAC Name:
2H-pyrazolo[3,4-b]pyridine-3-sulfonyl chloride
InChI:
InChI=1S/C6H4ClN3O2S/c7-13(11,12)6-4-2-1-3-8-5(4)9-10-6/h1-3H,(H,8,9,10)
InChI Key:
BRWSCLIIHQUTSP-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)c1n[nH]c2c1cccn2
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.971g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.627g/mol
Monoisotopic Mass:
216.971g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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