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methyl 2-amino-5-fluorobenzoate

methyl 2-amino-5-fluorobenzoate

Formula: C8H8FNO2

SMILES: COC(=O)C1=C(N)C=CC(F)=C1

IUPAC: methyl 2-amino-5-fluorobenzoate

InChI: InChI=1S/C8H8FNO2/c1-12-8(11)6-4-5(9)2-3-7(6)10/h2-4H,10H2,1H3

Composition: C (56.80%), H (4.77%), F (11.23%), N (8.28%), O (18.92%)

Molar Mass: 169.155

Atom Count: 20

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 169.053906665
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey PUDDYSBKCDKATP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 43
Topological Polar Surface Area 52.32
Polarizability 15.63
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime Formula PacketSize UnitPrice
99.22% <7 Days C8H8FNO2 $30.86-$122.49$30.86$122.49
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98% <14 Days C8H8FNO2 Quote Only
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