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methyl 3-fluoro-2-hydroxybenzoate

methyl 3-fluoro-2-hydroxybenzoate

CAS: 70163-98-3

Formula: C8H7FO3

SMILES: COC(=O)C1=CC=CC(F)=C1O

IUPAC: methyl 3-fluoro-2-hydroxybenzoate

InChI: InChI=1S/C8H7FO3/c1-12-8(11)5-3-2-4-6(9)7(5)10/h2-4,10H,1H3

Composition: C (56.48%), H (4.15%), F (11.17%), O (28.21%)

Molar Mass: 170.139

Atom Count: 19

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 170.037922248
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey NRGQRZHYRCJTKV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.28
Topological Polar Surface Area 46.53
Polarizability 15.14
Ring Count 1
Rotatable Bond Count 2

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98% <7 Days 70163-98-3 $42.08-$1,259.45$42.08$59.84$298.27$560.07$1,259.45
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98% <7 Days 70163-98-3 $37.26-$663.44$37.26$60.03$116.96$389.16$663.44
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