NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-(2-aminophenyl)-2,2,2-trifluoroethan-1-one
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IUPAC Traditional name
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1-(2-aminophenyl)-2,2,2-trifluoroethanone
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Synonyms
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2-(Trifluoroacetyl)aniline
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1-(2-Aminophenyl)-2,2,2-trifluoroethan-1-one
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2'-Amino-2,2,2-trifluoroacetophenone
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1-(2-aminophenyl)-2,2,2-trifluoroethanone
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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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19.648535
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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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2.4842455
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LogD (pH = 7.4)
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2.4842954
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Log P
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2.484296
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Molar Refractivity
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42.1714 cm3
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Polarizability
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14.647536 Å3
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Polar Surface Area
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43.09 Å2
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Rotatable Bonds
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2
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Lipinski's Rule of Five
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true
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PATENTS
PATENTS
PubChem Patent
Google Patent