methyl 2-[2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetate

methyl 2-[2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetate

CAS: 1415960-54-1

Formula: C16H23BO4

SMILES: COC(=O)CC1=CC=C(C=C1C)B1OC(C)(C)C(C)(C)O1

IUPAC: methyl 2-[2-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetate

InChI: InChI=1S/C16H23BO4/c1-11-9-13(8-7-12(11)10-14(18)19-6)17-20-15(2,3)16(4,5)21-17/h7-9H,10H2,1-6H3

Composition: C (66.23%), H (7.99%), B (3.73%), O (22.05%)

Molar Mass: 290.17

Atom Count: 44

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	290.168939
Formal Charge	0
FSP3	0.56
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	RMCPHBITAFLGEA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.83
Topological Polar Surface Area	44.76
Polarizability	32.05
Ring Count	2
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	1415960-54-1		$59.84-$2,370.23$59.84$72.00$118.75$474.05$2,370.23

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1415960-54-1		$215.63-$1,015.11$215.63$1,015.11