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ethyl 3-fluoro-4-formylbenzoate

ethyl 3-fluoro-4-formylbenzoate

CAS: 1640117-38-9

Formula: C10H9FO3

SMILES: CCOC(=O)C1=CC=C(C=O)C(F)=C1

IUPAC: ethyl 3-fluoro-4-formylbenzoate

InChI: InChI=1S/C10H9FO3/c1-2-14-10(13)7-3-4-8(6-12)9(11)5-7/h3-6H,2H2,1H3

Composition: C (61.23%), H (4.62%), F (9.68%), O (24.47%)

Molar Mass: 196.177

Atom Count: 23

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 196.053572313
Formal Charge 0
FSP3 0.2
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey CAIWTFXQTNXSOY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.63
Topological Polar Surface Area 43.37
Polarizability 18.23
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 1640117-38-9 $22.70-$105.92$22.70$40.35$105.92
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