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155790-12-8 | 3-Pyridinecarboxylic acid, 6-methyl-2-(methylamino)-
CAS No: 155790-12-8 Catalog No: AG001O7F MDL No:MFCD04038975
Product Description
Catalog Number:
AG001O7F
Chemical Name:
3-Pyridinecarboxylic acid, 6-methyl-2-(methylamino)-
CAS Number:
155790-12-8
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
MDL Number:
MFCD04038975
IUPAC Name:
6-methyl-2-(methylamino)pyridine-3-carboxylic acid
InChI:
InChI=1S/C8H10N2O2/c1-5-3-4-6(8(11)12)7(9-2)10-5/h3-4H,1-2H3,(H,9,10)(H,11,12)
InChI Key:
UBKYMSYGVDXKCI-UHFFFAOYSA-N
SMILES:
CNc1nc(C)ccc1C(=O)O
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
166.18g/mol
Monoisotopic Mass:
166.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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