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methyl 4-fluoropyridine-3-carboxylate

methyl 4-fluoropyridine-3-carboxylate

CAS: 1214375-37-7

Formula: C7H6FNO2

SMILES: COC(=O)C1=C(F)C=CN=C1

IUPAC: methyl 4-fluoropyridine-3-carboxylate

InChI: InChI=1S/C7H6FNO2/c1-11-7(10)5-4-9-3-2-6(5)8/h2-4H,1H3

Composition: C (54.20%), H (3.90%), F (12.25%), N (9.03%), O (20.63%)

Molar Mass: 155.128

Atom Count: 17

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 155.0382566
Formal Charge 0
FSP3 0.14
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey LNORHZUETHALBP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 36.14
Topological Polar Surface Area 39.19
Polarizability 13.64
Ring Count 1
Rotatable Bond Count 2

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