NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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5-ethoxy-1H-1,3-benzodiazole-2-thiol
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IUPAC Traditional name
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5-ethoxy-1H-1,3-benzodiazole-2-thiol
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Synonyms
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5-Ethoxy-1H-benzo[d]imidazole-2-thiol
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5-Ethoxy-2-mercaptobenzimidazole
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5-Ethoxybenzimidazole-2-thiol
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5-乙氧基-2-巯基苯并咪唑
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CAS Number
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MDL Number
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Beilstein 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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7.999886
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H Acceptors
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2
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H Donor
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2
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LogD (pH = 5.5)
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2.1468463
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LogD (pH = 7.4)
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2.141534
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Log P
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2.2360978
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Molar Refractivity
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53.6634 cm3
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Polarizability
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22.070969 Å3
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Polar Surface Area
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37.91 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
Sigma Aldrich
PATENTS
PATENTS
PubChem Patent
Google Patent