3-cyclopropylphenylboronic acid

3-cyclopropylphenylboronic acid

CAS: 1049730-10-0

Formula: C9H11BO2

SMILES: OB(O)C1=CC=CC(=C1)C1CC1

IUPAC: (3-cyclopropylphenyl)boronic acid

InChI: InChI=1S/C9H11BO2/c11-10(12)9-3-1-2-8(6-9)7-4-5-7/h1-3,6-7,11-12H,4-5H2

Composition: C (66.73%), H (6.84%), B (6.67%), O (19.75%)

Molar Mass: 162

Atom Count: 23

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	162.08521
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	BFFVQXUPALEVGS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.99
Topological Polar Surface Area	40.46
Polarizability	18.25
Ring Count	2
Rotatable Bond Count	2

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