2-(3-chloro-5-fluoro-4-propoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(3-chloro-5-fluoro-4-propoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Formula: C15H21BClFO3

SMILES: CCCOC1=C(F)C=C(C=C1Cl)B1OC(C)(C)C(C)(C)O1

IUPAC: 2-(3-chloro-5-fluoro-4-propoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

InChI: InChI=1S/C15H21BClFO3/c1-6-7-19-13-11(17)8-10(9-12(13)18)16-20-14(2,3)15(4,5)21-16/h8-9H,6-7H2,1-5H3

Composition: C (57.27%), H (6.73%), B (3.44%), Cl (11.27%), F (6.04%), O (15.26%)

Molar Mass: 314.59

Atom Count: 42

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	314.12563
Formal Charge	0
FSP3	0.6
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	LZOBBSFYCKAHCP-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	76.47
Topological Polar Surface Area	27.69
Polarizability	31.78
Ring Count	2
Rotatable Bond Count	4

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C15H21BClFO3		Quote Only