4-formylpyridine-3-carboxylic acid

4-formylpyridine-3-carboxylic acid

CAS: 395645-41-7

Formula: C7H5NO3

SMILES: OC(=O)C1=C(C=O)C=CN=C1

IUPAC: 4-formylpyridine-3-carboxylic acid

InChI: InChI=1S/C7H5NO3/c9-4-5-1-2-8-3-6(5)7(10)11/h1-4H,(H,10,11)

Composition: C (55.64%), H (3.34%), N (9.27%), O (31.76%)

Molar Mass: 151.121

Atom Count: 16

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	151.026943025
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	IZBZXXIISIPCHN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	37.74
Topological Polar Surface Area	67.26
Polarizability	13.75
Ring Count	1
Rotatable Bond Count	2

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