NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-hydroxycyclohepta-2,4,6-trien-1-one
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IUPAC Traditional name
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Synonyms
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2-Hydroxy-2,4,6-cycloheptatrienone
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TROPOLONE
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2-Hydroxytropone
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Purpurocatechol
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2-Hydroxy-2,4,6-cycloheptatrien-1-one
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Tropolone
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2-hydroxycyclohepta-2,4,6-trien-1-one
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品托酮
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2-羟基-2,4,6-环庚三烯-1-酮
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环庚三烯酚酮
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CAS Number
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EC Number
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MDL Number
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Beilstein Number
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PubChem SID
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PubChem CID
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CHEMBL
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Unique Ingredient Identifier
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Wikipedia Title
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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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11.260552
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H Acceptors
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2
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H Donor
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1
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LogD (pH = 5.5)
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1.0874965
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LogD (pH = 7.4)
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1.0874374
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Log P
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1.0874972
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Molar Refractivity
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38.119 cm3
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Polarizability
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12.862982 Å3
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Polar Surface Area
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37.3 Å2
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Rotatable Bonds
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0
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Lipinski's Rule of Five
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true
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DETAILS
DETAILS
MP Biomedicals
Wikipedia
Sigma Aldrich
Sigma Aldrich -
T89702
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Application Reagent for the preparation of fused heterocycles1 and complexes of Ga(III) and In(III).2 Sensitive reagent for reducing sugars. Packaging 1, 5, 25 g in glass bottle |
PATENTS
PATENTS
PubChem Patent
Google Patent