NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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[3-(propylcarbamoyl)phenyl]boronic acid
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IUPAC Traditional name
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3-(propylcarbamoyl)phenylboronic acid
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Synonyms
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3-(N-Propylaminocarbonyl)benzeneboronic acid 95%
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3-(N-PROPYLAMINOCARBONYL)PHENYLBORONIC ACID
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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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8.609139
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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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1.348164
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LogD (pH = 7.4)
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1.3226024
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Log P
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1.3485
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Molar Refractivity
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53.8512 cm3
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Polarizability
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21.894331 Å3
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Polar Surface Area
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69.56 Å2
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Rotatable Bonds
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4
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Lipinski's Rule of Five
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true
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PATENTS
PATENTS
PubChem Patent
Google Patent