4-(Methoxycarbonyl)benzeneboronic acid pinacol ester

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Catalog Number
ACM171364800
Product Name
4-(Methoxycarbonyl)benzeneboronic acid pinacol ester
Structure
Structure
CAS
171364-80-0
Category
Boronic Esters
Synonyms
4-METHOXYCARBONYLPHENYLBORONIC ACID, PINACOL ESTER;4-METHOXYCARBONYLPHENYLBORONIC ACID PINACOLATE;4-carbomethoxyphenylboronic acid pinacol ester;4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)BENZOIC ACID METHYL ESTER;2-(4-CARBOMETHOXYPHENYL)-4,4,5,5-TET
IUPAC Name
methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
Molecular Weight
262.11g/mol
Molecular Formula
C14H19BO4
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)C(=O)OC
InChI
InChI=1S/C14H19BO4/c1-13(2)14(3,4)19-15(18-13)11-8-6-10(7-9-11)12(16)17-5/h6-9H,1-5H3
InChI Key
REIZEQZILPXYKS-UHFFFAOYSA-N
Complexity
329
Covalently-Bonded Unit Count
1
Exact Mass
262.137639g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
0
Heavy Atom Count
19
Monoisotopic Mass
262.137639g/mol
Rotatable Bond Count
3
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