2,5-dichloropyridin-4-ylboronic acid

2,5-dichloropyridin-4-ylboronic acid

CAS: 847664-64-6

Formula: C5H4BCl2NO2

SMILES: OB(O)C1=CC(Cl)=NC=C1Cl

IUPAC: (2,5-dichloropyridin-4-yl)boronic acid

InChI: InChI=1S/C5H4BCl2NO2/c7-4-2-9-5(8)1-3(4)6(10)11/h1-2,10-11H

Composition: C (31.31%), H (2.10%), B (5.64%), Cl (36.97%), N (7.30%), O (16.68%)

Molar Mass: 191.8

Atom Count: 15

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	190.971214
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	BEJJMDOFMZCRST-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	39.12
Topological Polar Surface Area	53.35
Polarizability	16.6
Ring Count	1
Rotatable Bond Count	1

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