3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]prop-2-yn-1-ol

3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]prop-2-yn-1-ol

CAS: 1449133-12-3

Formula: C15H19BO3

SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(C=C1)C#CCO

IUPAC: 3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]prop-2-yn-1-ol

InChI: InChI=1S/C15H19BO3/c1-14(2)15(3,4)19-16(18-14)13-9-7-12(8-10-13)6-5-11-17/h7-10,17H,11H2,1-4H3

Composition: C (69.80%), H (7.42%), B (4.19%), O (18.59%)

Molar Mass: 258.12

Atom Count: 38

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	258.142724
Formal Charge	0
FSP3	0.47
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	SYRFTFKBNBRKRB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.16
Topological Polar Surface Area	38.69
Polarizability	29.04
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	1449133-12-3		$45.89-$174.80$45.89$51.35$62.27$63.37$86.31$174.80