NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-[cyano(thiophen-2-yl)methyl]-6-fluorobenzonitrile
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IUPAC Traditional name
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2-[cyano(thiophen-2-yl)methyl]-6-fluorobenzonitrile
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Synonyms
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2-[Cyano(2-thienyl)methyl]-6-fluorobenzenecarbonitrile
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2-(2-Cyano-3-fluoro)-2-(thien-2-yl)acetonitrile 97%
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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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8.910891
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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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3.2572443
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LogD (pH = 7.4)
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3.244234
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Log P
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3.2574127
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Molar Refractivity
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63.8423 cm3
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Polarizability
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23.611265 Å3
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Polar Surface Area
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47.58 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