4-hydroxy-3,5-dimethylphenylboronic acid

4-hydroxy-3,5-dimethylphenylboronic acid

CAS: 934826-20-7

Formula: C8H11BO3

SMILES: CC1=CC(=CC(C)=C1O)B(O)O

IUPAC: (4-hydroxy-3,5-dimethylphenyl)boronic acid

InChI: InChI=1S/C8H11BO3/c1-5-3-7(9(11)12)4-6(2)8(5)10/h3-4,10-12H,1-2H3

Composition: C (57.89%), H (6.68%), B (6.51%), O (28.92%)

Molar Mass: 165.98

Atom Count: 23

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	166.080124
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
InChIKey	SJSCEQJHOXBRSS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.67
Topological Polar Surface Area	60.69
Polarizability	17.67
Ring Count	1
Rotatable Bond Count	1

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