3-(formyloxy)phenylboronic acid

3-(formyloxy)phenylboronic acid

CAS: 25487-66-5

Formula: C7H7BO4

SMILES: OB(O)C1=CC=CC(OC=O)=C1

IUPAC: [3-(formyloxy)phenyl]boronic acid

InChI: InChI=1S/C7H7BO4/c9-5-12-7-3-1-2-6(4-7)8(10)11/h1-5,10-11H

Composition: C (50.67%), H (4.25%), B (6.51%), O (38.57%)

Molar Mass: 165.94

Atom Count: 19

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	166.043739
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	CGKZLXUMUJKVPS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	37.25
Topological Polar Surface Area	66.76
Polarizability	16.15
Ring Count	1
Rotatable Bond Count	3

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