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Home > Pyridines > 1138218-44-6
1138218-44-6 | 6-methoxypyridine-2-sulfinic acid
CAS No: 1138218-44-6 Catalog No: AG01BCJD MDL No:
Product Description
Catalog Number:
AG01BCJD
Chemical Name:
6-methoxypyridine-2-sulfinic acid
CAS Number:
1138218-44-6
Molecular Formula:
C6H7NO3S
Molecular Weight:
173.1897
IUPAC Name:
6-methoxypyridine-2-sulfinic acid
InChI:
InChI=1S/C6H7NO3S/c1-10-5-3-2-4-6(7-5)11(8)9/h2-4H,1H3,(H,8,9)
InChI Key:
KUJNUTDSARUKIJ-UHFFFAOYSA-N
SMILES:
COc1cccc(n1)S(=O)O
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.015g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.186g/mol
Monoisotopic Mass:
173.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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