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3,5-difluoro-4-methoxyphenylboronic acid

3,5-difluoro-4-methoxyphenylboronic acid

CAS: 208641-98-9

Formula: C7H7BF2O3

SMILES: COC1=C(F)C=C(C=C1F)B(O)O

IUPAC: (3,5-difluoro-4-methoxyphenyl)boronic acid

InChI: InChI=1S/C7H7BF2O3/c1-13-7-5(9)2-4(8(11)12)3-6(7)10/h2-3,11-12H,1H3

Composition: C (44.74%), H (3.75%), B (5.75%), F (20.22%), O (25.54%)

Molar Mass: 187.94

Atom Count: 20

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 188.04563
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey JJRIEFCRGWHLES-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.5
Topological Polar Surface Area 49.69
Polarizability 15.6
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 208641-98-9 $9.32-$104.54$9.32$17.60$31.05$104.54
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Key Organics Ltd
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98% <2 Days 208641-98-9 $51.35-$86.31$51.35$63.37$86.31
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AA BLOCKS INC
Purity LeadTime CAS PacketSize UnitPrice
97% <6 Days 208641-98-9 $11.50-$42.55$11.50$42.55
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Kinentia Biosciences LLC
Purity LeadTime CAS PacketSize UnitPrice
95% <14 Days 208641-98-9 $816.48$816.48
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97% <5 Days 208641-98-9 $13.87-$264.81$13.87$70.62$264.81
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ChemBridge Corp.
Purity LeadTime CAS PacketSize UnitPrice
95% <4 Days 208641-98-9 $88.55-$576.15$88.55$177.10$576.15
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