6-methylpyridine-3-carboxylic acid

6-methylpyridine-3-carboxylic acid

CAS: 3222-47-7

Formula: C7H7NO2

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

IUPAC: 6-methylpyridine-3-carboxylic acid

InChI: InChI=1S/C7H7NO2/c1-5-2-3-6(4-8-5)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	RZOKQIPOABEQAM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	35.75
Topological Polar Surface Area	50.19
Polarizability	13.55
Ring Count	1
Rotatable Bond Count	1

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