2-[4-methoxy-3-(trifluoromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-[4-methoxy-3-(trifluoromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Formula: C14H18BF3O3

SMILES: COC1=C(C=C(C=C1)B1OC(C)(C)C(C)(C)O1)C(F)(F)F

IUPAC: 2-[4-methoxy-3-(trifluoromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

InChI: InChI=1S/C14H18BF3O3/c1-12(2)13(3,4)21-15(20-12)9-6-7-11(19-5)10(8-9)14(16,17)18/h6-8H,1-5H3

Composition: C (55.66%), H (6.01%), B (3.58%), F (18.87%), O (15.89%)

Molar Mass: 302.1

Atom Count: 39

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	302.130109
Formal Charge	0
FSP3	0.57
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	MDCAOOMRVSIDTJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.15
Topological Polar Surface Area	27.69
Polarizability	27.61
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C14H18BF3O3		Quote Only