NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1,3-difluoro-2-(trifluoromethoxy)benzene
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IUPAC Traditional name
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1,3-difluoro-2-(trifluoromethoxy)benzene
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Synonyms
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2,6-Difluoro(trifluoromethoxy)benzene
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1,3-Difluoro-2-(trifluoromethoxy)benzene
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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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1
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H Donor
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0
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LogD (pH = 5.5)
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3.6897612
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LogD (pH = 7.4)
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3.6897612
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Log P
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3.6897612
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Molar Refractivity
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29.5611 cm3
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Polarizability
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12.212919 Å3
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Polar Surface Area
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9.23 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
Safety Information
Product Information
Bioassay(PubChem)
DETAILS
DETAILS
TRC
REFERENCES
REFERENCES
From Suppliers
Google Scholar
PubMed
Google Books
- • Umemiya, H., et al.: J. Med. Chem., 40, 4222 (1997)
- • Ebisawa, M., et al.: Chem. Pharm. Bull., 47, 1778 (1997)
- • Gernert, D.L., et al.: Bioorg. Med. Chem. Lett., 14, 2759 (1997)
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PATENTS
PATENTS
PubChem Patent
Google Patent