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4-formylfuran-2-ylboronic acid

4-formylfuran-2-ylboronic acid

CAS: 62306-78-9

Formula: C5H5BO4

SMILES: OB(O)C1=CC(C=O)=CO1

IUPAC: (4-formylfuran-2-yl)boronic acid

InChI: InChI=1S/C5H5BO4/c7-2-4-1-5(6(8)9)10-3-4/h1-3,8-9H

Composition: C (42.93%), H (3.60%), B (7.73%), O (45.74%)

Molar Mass: 139.9

Atom Count: 15

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 140.028089
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey WHHDYDVWDKATTB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 28.95
Topological Polar Surface Area 70.67
Polarizability 12.41
Ring Count 1
Rotatable Bond Count 2

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