NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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3-bromo-4-[3-(2-bromo-4-cyanophenoxy)propoxy]benzonitrile
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IUPAC Traditional name
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3-bromo-4-[3-(2-bromo-4-cyanophenoxy)propoxy]benzonitrile
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Synonyms
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4,4'-[1,3-Propanediylbis(oxy)]bis[3-bromo-benzonitrile
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1,3-Bis(2'bromo-4'-cyano-phenoxy)propane
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CAS 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
Data Source
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Data ID
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Price
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TRC
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CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
H Acceptors
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4
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H Donor
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0
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LogD (pH = 5.5)
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4.7692814
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LogD (pH = 7.4)
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4.7692814
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Log P
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4.7692814
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Molar Refractivity
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94.6276 cm3
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Polarizability
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36.168755 Å3
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Polar Surface Area
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66.04 Å2
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Rotatable Bonds
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6
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Lipinski's Rule of Five
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true
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PROPERTIES
PROPERTIES
Physical Property
Safety Information
Product Information
Bioassay(PubChem)
Solubility
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Chloroform
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Show
data source
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Apperance
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White Solid
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Show
data source
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DETAILS
DETAILS
TRC
PATENTS
PATENTS
PubChem Patent
Google Patent