4-methoxycarbonylphenylboronic acid

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4-methoxycarbonylphenylboronic acid
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4-(Methoxycarbonyl)phenylboronic Acid is used in the synthesis and evaluation of several organic compounds including that of 4-Cyclohexylbutyl-N-[(S)-2-oxoazetidin-3-yl]carbamate which is a potent inhibitor of intracellular NAAA activity. Also used in the design and synthesis of BMS-955176 which is a potent, orally active second generation HIV-1 maturation inhibitor.

Category
Peptide Synthesis Reagents
Catalog number
BAT-006312
CAS number
99768-12-4
Molecular Formula
C8H9BO4
Molecular Weight
179.97
4-methoxycarbonylphenylboronic acid
IUPAC Name
(4-methoxycarbonylphenyl)boronic acid
Synonyms
Methyl 4-boronobenzoate; (4-Carbomethoxyphenyl)boronic Acid; 4-Carbomethoxybenzeneboronic Acid; 4-Methoxycarbonylbenzeneboronic Acid; Methyl p-Boronobenzoate; p-(Methoxycarbonyl)boronic Acid; p-(Methoxycarbonyl)phenylboronic Acid; Benzoic acid, 4-borono-, 1-methyl ester; DTXSID40370259; Methyl 4-(dihydroxyboryl)benzoate; BP-11412; BR-45488; CC-19763
Related CAS
1373752-82-9 (deleted)
Appearance
White to yellowish crystal powder
Purity
> 98 % (HPLC)
Density
1.250±0.10 g/cm3 (Predicted)
Melting Point
197-200 ℃
Boiling Point
345.8±44.0 ℃ (Predicted)
Storage
2-8 ℃ under inert atmosphere
Solubility
Slightly soluble in DMSO, Methanol
InChI
InChI=1S/C8H9BO4/c1-13-8(10)6-2-4-7(5-3-6)9(11)12/h2-5,11-12H,1H3
InChI Key
PQCXFUXRTRESBD-UHFFFAOYSA-N
Canonical SMILES
B(C1=CC=C(C=C1)C(=O)OC)(O)O

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