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6-methylpyridine-2-carboxylic acid

6-methylpyridine-2-carboxylic acid

CAS: 934-60-1

Formula: C7H7NO2

SMILES: CC1=CC=CC(=N1)C(O)=O

IUPAC: 6-methylpyridine-2-carboxylic acid

InChI: InChI=1S/C7H7NO2/c1-5-3-2-4-6(8-5)7(9)10/h2-4H,1H3,(H,9,10)

Composition: C (61.31%), H (5.15%), N (10.21%), O (23.33%)

Molar Mass: 137.138

Atom Count: 17

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 137.047678469
Formal Charge 0
FSP3 0.14
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey LTUUGSGSUZRPRV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 35.38
Topological Polar Surface Area 50.19
Polarizability 13.55
Ring Count 1
Rotatable Bond Count 1

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