2-(3-methanesulfinylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(3-methanesulfinylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

CAS: 1416367-04-8

Formula: C13H19BO3S

SMILES: CS(=O)C1=CC=CC(=C1)B1OC(C)(C)C(C)(C)O1

IUPAC: 2-(3-methanesulfinylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

InChI: InChI=1/C13H19BO3S/c1-12(2)13(3,4)17-14(16-12)10-7-6-8-11(9-10)18(5)15/h6-9H,1-5H3

Composition: C (58.66%), H (7.20%), B (4.06%), O (18.03%), S (12.05%)

Molar Mass: 266.16

Atom Count: 37

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	266.114796
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	WRVNLMRGJRLGQE-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.07
Topological Polar Surface Area	35.53
Polarizability	29.43
Ring Count	2
Rotatable Bond Count	2

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