5-cyclopropylpyridin-3-ylboronic acid

5-cyclopropylpyridin-3-ylboronic acid

CAS: 1044210-58-3

Formula: C8H10BNO2

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

IUPAC: (5-cyclopropylpyridin-3-yl)boronic acid

InChI: InChI=1S/C8H10BNO2/c11-9(12)8-3-7(4-10-5-8)6-1-2-6/h3-6,11-12H,1-2H2

Composition: C (58.96%), H (6.18%), B (6.63%), N (8.59%), O (19.63%)

Molar Mass: 162.98

Atom Count: 22

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	163.080459
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	MLRXPBXNCWRWOM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.84
Topological Polar Surface Area	53.35
Polarizability	17.35
Ring Count	2
Rotatable Bond Count	2

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