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

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

CAS: 889654-06-2

Formula: C15H21BO5

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

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

InChI: InChI=1S/C15H21BO5/c1-14(2)15(3,4)21-16(20-14)11-7-10(13(17)19-6)8-12(9-11)18-5/h7-9H,1-6H3

Composition: C (61.67%), H (7.25%), B (3.70%), O (27.38%)

Molar Mass: 292.14

Atom Count: 42

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	292.148204
Formal Charge	0
FSP3	0.53
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	ZBLGLKWSVGSAQD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.2
Topological Polar Surface Area	53.99
Polarizability	30.95
Ring Count	2
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<2 Days	889654-06-2		$140.30-$2,162.00$140.30$165.60$216.20$316.25$517.50$2,162.00