methyl 4-fluoro-2-methoxybenzoate

methyl 4-fluoro-2-methoxybenzoate

CAS: 204707-42-6

Formula: C9H9FO3

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

IUPAC: methyl 4-fluoro-2-methoxybenzoate

InChI: InChI=1S/C9H9FO3/c1-12-8-5-6(10)3-4-7(8)9(11)13-2/h3-5H,1-2H3

Composition: C (58.70%), H (4.93%), F (10.32%), O (26.06%)

Molar Mass: 184.166

Atom Count: 22

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	184.053572313
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	LJUAEPNTXDJBRX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.76
Topological Polar Surface Area	35.53
Polarizability	17.02
Ring Count	1
Rotatable Bond Count	3

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