NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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(2S,6'R)-7-chloro-2'-hydroxy-4,6-dimethoxy-6'-methyl-3H-spiro[1-benzofuran-2,1'-cyclohexan]-2'-ene-3,4'-dione
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IUPAC Traditional name
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(2S,6'R)-7-chloro-2'-hydroxy-4,6-dimethoxy-6'-methylspiro[1-benzofuran-2,1'-cyclohexan]-2'-ene-3,4'-dione
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Synonyms
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(1'S,6'R)-7-Chloro-4'-hydroxy-4,6-dimethoxy-6'-methyl-spiro[benzofuran-2(3H),1'-[3]cyclohexene]-2',3-dione
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4'-O-Demethyl Griseofulvin
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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
Acid pKa
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4.2226887
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H Acceptors
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6
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H Donor
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1
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LogD (pH = 5.5)
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0.76207334
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LogD (pH = 7.4)
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-0.95858103
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Log P
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2.05931
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Molar Refractivity
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83.0947 cm3
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Polarizability
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31.866516 Å3
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Polar Surface Area
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82.06 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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DETAILS
DETAILS
TRC
PATENTS
PATENTS
PubChem Patent
Google Patent