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methyl 3,5-difluoro-2-methoxybenzoate

methyl 3,5-difluoro-2-methoxybenzoate

Formula: C9H8F2O3

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

IUPAC: methyl 3,5-difluoro-2-methoxybenzoate

InChI: InChI=1S/C9H8F2O3/c1-13-8-6(9(12)14-2)3-5(10)4-7(8)11/h3-4H,1-2H3

Composition: C (53.47%), H (3.99%), F (18.80%), O (23.74%)

Molar Mass: 202.157

Atom Count: 22

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 202.044150444
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey CQCBFDPJGAOBOH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.98
Topological Polar Surface Area 35.53
Polarizability 16.85
Ring Count 1
Rotatable Bond Count 3

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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C9H8F2O3 $1,760.00-$3,278.00$1,760.00$3,278.00
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