NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)[2-(2,6-dimethoxyphenoxy)ethyl]amine hydrochloride
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IUPAC Traditional name
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(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)[2-(2,6-dimethoxyphenoxy)ethyl]amine hydrochloride
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Synonyms
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WB-4101 hydrochloride
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2-[(2,6-二甲氧基苯氧乙基)氨基甲基]-1,4-苯并二噁烷 盐酸盐
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WB-4101 盐酸盐
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CAS Number
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EC Number
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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
H Acceptors
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6
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H Donor
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1
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LogD (pH = 5.5)
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-0.43817058
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LogD (pH = 7.4)
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1.1404612
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Log P
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2.5104492
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Molar Refractivity
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92.8886 cm3
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Polarizability
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37.00304 Å3
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Polar Surface Area
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58.18 Å2
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Rotatable Bonds
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8
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Lipinski's Rule of Five
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true
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PROPERTIES
PROPERTIES
Safety Information
Bioassay(PubChem)
German water hazard class
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3
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Show
data source
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Personal Protective Equipment
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Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
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Show
data source
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PATENTS
PATENTS
PubChem Patent
Google Patent