dimethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenylphosphonate

dimethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenylphosphonate

CAS: 852204-67-2

Formula: C14H22BO5P

SMILES: COP(=O)(OC)C1=CC=C(C=C1)B1OC(C)(C)C(C)(C)O1

IUPAC: dimethyl [4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]phosphonate

InChI: InChI=1S/C14H22BO5P/c1-13(2)14(3,4)20-15(19-13)11-7-9-12(10-8-11)21(16,17-5)18-6/h7-10H,1-6H3

Composition: C (53.88%), H (7.11%), B (3.46%), O (25.63%), P (9.92%)

Molar Mass: 312.11

Atom Count: 43

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	312.129791
Formal Charge	0
FSP3	0.57
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	CUAVYPNLRRVECY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.87
Topological Polar Surface Area	53.99
Polarizability	32.34
Ring Count	2
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	852204-67-2		$61.79-$147.54$61.79$147.54