NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-methoxy-N-[(Z)-1-(methylsulfanyl)-2-nitroethenyl]aniline
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IUPAC Traditional name
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4-methoxy-N-[(Z)-1-(methylsulfanyl)-2-nitroethenyl]aniline
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Synonyms
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4-Methoxy-N-[1-(methylsulfanyl)-2-nitrovinyl]aniline
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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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11.185609
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H Acceptors
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4
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H Donor
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1
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LogD (pH = 5.5)
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2.3890314
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LogD (pH = 7.4)
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2.3889647
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Log P
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2.3890324
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Molar Refractivity
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74.7677 cm3
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Polarizability
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24.274574 Å3
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Polar Surface Area
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67.08 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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true
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PATENTS
PATENTS
PubChem Patent
Google Patent