NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4,6-dimethyl-2-sulfanylpyridine-3-carbonitrile
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IUPAC Traditional name
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4,6-dimethyl-2-sulfanylpyridine-3-carbonitrile
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Synonyms
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2-Mercapto-4,6-dimethylnicotinonitrile
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5-Cyano-6-mercapto-2,4-lutidine
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4,6-Dimethyl-2-mercaptonicotinonitrile
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3-Cyano-4,6-dimethyl-2-mercaptopyridine
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3-氰基-4,6-二甲基-2-巯基吡啶
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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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7.2018948
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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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1.935906
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LogD (pH = 7.4)
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1.5577965
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Log P
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1.9441259
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Molar Refractivity
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47.5787 cm3
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Polarizability
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17.85038 Å3
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Polar Surface Area
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36.68 Å2
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Rotatable Bonds
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0
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Lipinski's Rule of Five
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true
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PATENTS
PATENTS
PubChem Patent
Google Patent