NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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3-benzoyl-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
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IUPAC Traditional name
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3-benzoyl-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
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Synonyms
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(1S,4R)-3-benzoyl-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
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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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7.646907
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H Acceptors
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2
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H Donor
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0
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LogD (pH = 5.5)
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4.0388427
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LogD (pH = 7.4)
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3.8489647
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Log P
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4.0419035
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Molar Refractivity
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74.6008 cm3
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Polarizability
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29.254404 Å3
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Polar Surface Area
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34.14 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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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent