NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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ethyl 2-(2-chloropropanamido)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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IUPAC Traditional name
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ethyl 2-(2-chloropropanamido)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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Synonyms
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Ethyl 2-[(2-chloropropanoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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2-(2-Chloro-propionylamino)-6-methyl-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylic acid ethyl ester
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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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9.981128
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H Acceptors
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2
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H Donor
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1
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LogD (pH = 5.5)
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5.1454864
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LogD (pH = 7.4)
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5.1444187
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Log P
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5.1454997
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Molar Refractivity
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85.1766 cm3
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Polarizability
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32.221687 Å3
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Polar Surface Area
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55.4 Å2
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Rotatable Bonds
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5
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Lipinski's Rule of Five
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false
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PATENTS
PATENTS
PubChem Patent
Google Patent