NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-{[1-(2H-1,3-benzodioxol-5-yl)propan-2-yl]amino}ethan-1-ol
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IUPAC Traditional name
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2-{[1-(2H-1,3-benzodioxol-5-yl)propan-2-yl]amino}ethanol
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Synonyms
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3,4-Methylenedioxy-N-hydroxyethylamphetamine
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3,4-Methylenedioxy-1-(alpha-methylaminohydroxyethyl)ethane
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MDOHET, MDHET, MDHEA
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Methylenedioxyhydroxyethylamphetamine
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CAS Number
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PubChem SID
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PubChem CID
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Wikipedia Title
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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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CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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15.601731
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H Acceptors
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4
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H Donor
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2
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LogD (pH = 5.5)
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-2.0176952
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LogD (pH = 7.4)
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-1.0102589
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Log P
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1.1699623
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Molar Refractivity
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60.539 cm3
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Polarizability
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24.06982 Å3
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Polar Surface Area
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50.72 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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PROPERTIES
PROPERTIES
Bioassay(PubChem)
DETAILS
DETAILS
Wikipedia
PATENTS
PATENTS
PubChem Patent
Google Patent