NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
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IUPAC Traditional name
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4-(tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
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Synonyms
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4-Carboxyphenylboronic acid pinacol ester
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4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
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4-Carboxybenzeneboronic acid, pinacol ester
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4-Carboxylphenylboronic acid pinacol ester
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4-Carboxylphenylboronic acid pinacol ester
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4-Carboxybenzeneboronic acid pinacol ester
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4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
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4-(4,4,5,5-四甲基-1,3,2-二氧杂硼烷-2-基)苯甲酸
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4-羧基苯硼酸频哪醇酯
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4-羧基苯硼酸频哪酯
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CAS Number
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MDL Number
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PubChem SID
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PubChem CID
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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3.5736194
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H Acceptors
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4
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H Donor
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1
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LogD (pH = 5.5)
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1.4923793
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LogD (pH = 7.4)
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-0.030371195
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Log P
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3.4163
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Molar Refractivity
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62.9693 cm3
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Polarizability
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26.329058 Å3
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Polar Surface Area
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55.76 Å2
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Rotatable Bonds
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2
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Lipinski's Rule of Five
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true
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DETAILS
DETAILS
Sigma Aldrich
PATENTS
PATENTS
PubChem Patent
Google Patent