NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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3-(heptafluoropropyl)-4-nitro-5-phenyl-1H-pyrazole
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IUPAC Traditional name
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3-(heptafluoropropyl)-4-nitro-5-phenyl-1H-pyrazole
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Synonyms
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3-(Heptafluoropropyl)-4-nitro-5-phenylpyrazole
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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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7.7564173
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H Acceptors
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3
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H Donor
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1
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LogD (pH = 5.5)
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4.4472837
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LogD (pH = 7.4)
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4.295871
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Log P
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4.4496245
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Molar Refractivity
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67.0215 cm3
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Polarizability
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24.504765 Å3
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Polar Surface Area
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74.5 Å2
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Rotatable Bonds
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5
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Lipinski's Rule of Five
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true
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PROPERTIES
PROPERTIES
Safety Information
Bioassay(PubChem)
Storage Warning
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Irritant
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Show
data source
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PATENTS
PATENTS
PubChem Patent
Google Patent