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123811-72-3 | 2-Pyridinecarboxylic acid, 3-methyl-, hydrochloride (1:1)
CAS No: 123811-72-3 Catalog No: AG000L4J MDL No:MFCD04114110
Product Description
Catalog Number:
AG000L4J
Chemical Name:
2-Pyridinecarboxylic acid, 3-methyl-, hydrochloride (1:1)
CAS Number:
123811-72-3
Molecular Formula:
C7H8ClNO2
Molecular Weight:
173.5969
MDL Number:
MFCD04114110
IUPAC Name:
3-methylpyridine-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C7H7NO2.ClH/c1-5-3-2-4-8-6(5)7(9)10;/h2-4H,1H3,(H,9,10);1H
InChI Key:
ADZVDJRKIHGDQW-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncccc1C.Cl
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.024g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
173.596g/mol
Monoisotopic Mass:
173.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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