NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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[4-(2-{[(benzyloxy)carbonyl]amino}ethyl)phenyl]boronic acid
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IUPAC Traditional name
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4-(2-{[(benzyloxy)carbonyl]amino}ethyl)phenylboronic acid
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Synonyms
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(4-(2-(((Benzyloxy)carbonyl)amino)ethyl)phenyl)boronic acid
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4-{2-[(Benzyloxycarbonyl)amino]ethyl}benzeneboronic acid
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4-(2-Aminoethyl)benzeneboronic acid, N-CBZ protected 98%
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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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8.7523575
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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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3.2369585
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LogD (pH = 7.4)
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3.218423
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Log P
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3.2372
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Molar Refractivity
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79.5119 cm3
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Polarizability
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32.387375 Å3
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Polar Surface Area
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78.79 Å2
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Rotatable Bonds
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7
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Lipinski's Rule of Five
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true
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PATENTS
PATENTS
PubChem Patent
Google Patent