NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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[4-(1-amino-2-methylpropan-2-yl)phenyl]boronic acid hydrochloride
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IUPAC Traditional name
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4-(1-amino-2-methylpropan-2-yl)phenylboronic acid hydrochloride
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Synonyms
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(4-(1-Amino-2-methylpropan-2-yl)phenyl)boronic acid hydrochloride
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2-Methyl-2-(4-boronophenyl)propylamine hydrochloride
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4-(2-Amino-1,1-dimethylethyl)benzeneboronic acid hydrochloride
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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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8.68254
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H Acceptors
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3
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H Donor
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3
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LogD (pH = 5.5)
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-1.3833617
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LogD (pH = 7.4)
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-0.038087662
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Log P
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1.0112205
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Molar Refractivity
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52.7016 cm3
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Polarizability
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22.352543 Å3
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Polar Surface Area
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66.48 Å2
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Rotatable Bonds
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3
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Lipinski's Rule of Five
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true
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PROPERTIES
PROPERTIES
Safety Information
Product Information
Bioassay(PubChem)
Storage Warning
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Irritant
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Show
data source
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Purity
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95+%
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Show
data source
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PATENTS
PATENTS
PubChem Patent
Google Patent