NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-[(3-hydroxy-2,4,6-triiodophenyl)methyl]butanoic acid
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IUPAC Traditional name
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Synonyms
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Iophenoxic acid
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α-Ethyl-3-hydroxy-2,4,6-triiodohydrocinnamic acid
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α-乙基-3-羟基-2,4,6-三碘氢化肉桂酸
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碘芬酸
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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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2.427351
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H Acceptors
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3
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H Donor
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2
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LogD (pH = 5.5)
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2.5613458
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LogD (pH = 7.4)
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1.3111224
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Log P
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5.526386
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Molar Refractivity
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93.2105 cm3
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Polarizability
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36.91875 Å3
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Polar Surface Area
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57.53 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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false
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DETAILS
DETAILS
Sigma Aldrich
PATENTS
PATENTS
PubChem Patent
Google Patent