NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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3-amino-1-[3,5-bis(trifluoromethyl)phenyl]thiourea
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IUPAC Traditional name
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3-amino-1-[3,5-bis(trifluoromethyl)phenyl]thiourea
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Synonyms
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4-[3,5-Di(trifluoromethyl)phenyl]-3-thiosemicarbazide
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4-[3,5-Bis(trifluoromethyl)phenyl]-3-thiosemicabazide 97%
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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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9.275107
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H Acceptors
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1
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H Donor
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3
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LogD (pH = 5.5)
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3.220105
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LogD (pH = 7.4)
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3.2209578
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Log P
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3.2265015
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Molar Refractivity
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64.0201 cm3
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Polarizability
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21.916275 Å3
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Polar Surface Area
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50.08 Å2
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Rotatable Bonds
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3
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Lipinski's Rule of Five
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true
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PATENTS
PATENTS
PubChem Patent
Google Patent