NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethan-1-one
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IUPAC Traditional name
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2,2,2-trifluoro-1-(2,4,6-trimethylphenyl)ethanone
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Synonyms
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2,2,2-Trifluoro-2',4',6'-trimethylacetophenone 97%
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2,2,2-Trifluoro-2′,4′,6′-trimethylacetophenone
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2,2,2-三氟-2',4',6'-三甲基苯乙酮
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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
H Acceptors
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1
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H Donor
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0
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LogD (pH = 5.5)
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4.203486
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LogD (pH = 7.4)
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4.203486
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Log P
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4.203486
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Molar Refractivity
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52.5946 cm3
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Polarizability
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18.650385 Å3
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Polar Surface Area
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17.07 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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DETAILS
DETAILS
Apollo Scientific
Sigma Aldrich
Apollo Scientific Ltd -
PC4354
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J. Org. Chem., 56, 893 (1991): chiral educt reagent produced with high enantioselectivity on treatment with chiral reducing agents |
PATENTS
PATENTS
PubChem Patent
Google Patent