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4-ethyl-3-fluorophenylboronic acid

4-ethyl-3-fluorophenylboronic acid

CAS: 1318760-09-6

Formula: C8H10BFO2

SMILES: CCC1=CC=C(C=C1F)B(O)O

IUPAC: (4-ethyl-3-fluorophenyl)boronic acid

InChI: InChI=1S/C8H10BFO2/c1-2-6-3-4-7(9(11)12)5-8(6)10/h3-5,11-12H,2H2,1H3

Composition: C (57.20%), H (6.00%), B (6.44%), F (11.31%), O (19.05%)

Molar Mass: 167.97

Atom Count: 22

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 168.075788
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey WSKYKIKQGUYJSL-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.46
Topological Polar Surface Area 40.46
Polarizability 16.81
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 1318760-09-6 $90.79-$417.39$90.79$155.10$417.39
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