2-{4-[(cyclopentylsulfanyl)methyl]phenyl}-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-{4-[(cyclopentylsulfanyl)methyl]phenyl}-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Formula: C18H27BO2S

SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(CSC2CCCC2)C=C1

IUPAC: 2-{4-[(cyclopentylsulfanyl)methyl]phenyl}-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

InChI: InChI=1S/C18H27BO2S/c1-17(2)18(3,4)21-19(20-17)15-11-9-14(10-12-15)13-22-16-7-5-6-8-16/h9-12,16H,5-8,13H2,1-4H3

Composition: C (67.93%), H (8.55%), B (3.40%), O (10.05%), S (10.07%)

Molar Mass: 318.28

Atom Count: 49

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	318.182481
Formal Charge	0
FSP3	0.67
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	IBWNPLQWTZMPSJ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	89.72
Topological Polar Surface Area	18.46
Polarizability	37.4
Ring Count	3
Rotatable Bond Count	4

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C18H27BO2S		Quote Only