3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol

3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol

CAS: 946427-03-8

Formula: C13H19BO3

SMILES: CC1=C(C=CC(O)=C1)B1OC(C)(C)C(C)(C)O1

IUPAC: 3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol

InChI: InChI=1S/C13H19BO3/c1-9-8-10(15)6-7-11(9)14-16-12(2,3)13(4,5)17-14/h6-8,15H,1-5H3

Composition: C (66.70%), H (8.18%), B (4.62%), O (20.50%)

Molar Mass: 234.1

Atom Count: 36

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	234.142724
Formal Charge	0
FSP3	0.54
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	KQELZLCLCNPDMC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.74
Topological Polar Surface Area	38.69
Polarizability	26.37
Ring Count	2
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	CAS		UnitPrice
98%	<14 Days	946427-03-8		Quote Only

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	946427-03-8		$45.40-$1,511.94$45.40$76.92$1,511.94

ChemBridge Corp.

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<4 Days	946427-03-8		$152.95-$379.50$152.95$379.50