NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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ethyl 2-hydroxy-2-(4-hydroxyphenyl)acetate
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IUPAC Traditional name
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ethyl 2-hydroxy-2-(4-hydroxyphenyl)acetate
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Synonyms
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4-Hydroxymandelic acid ethyl ester
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Ethyl 4-hydroxymandelate
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Ethyl hydroxy(4-hydroxyphenyl)acetate
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4-(2-Ethoxy-1-hydroxy-2-oxoethyl)phenol
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Ethyl 4-hydroxymandelate
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4-羟基扁桃酸乙酯
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CAS Number
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EC 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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9.461957
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H Acceptors
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3
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H Donor
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2
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LogD (pH = 5.5)
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1.0949252
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LogD (pH = 7.4)
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1.0912449
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Log P
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1.0949724
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Molar Refractivity
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50.2024 cm3
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Polarizability
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19.711418 Å3
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Polar Surface Area
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66.76 Å2
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Rotatable Bonds
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4
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Lipinski's Rule of Five
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true
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PATENTS
PATENTS
PubChem Patent
Google Patent