NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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IUPAC Traditional name
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Synonyms
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1,4-Butynediol-d4
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1,4-Dihydroxy-2-butyne
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-d4 Bis(hydroxymethyl)acetylene-d4
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NSC 834-d4
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2-Butyne-1,4-diol-(1,1,4,4)-d4
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CAS 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
Data Source
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Data ID
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Price
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TRC
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CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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13.944241
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H Acceptors
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2
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H Donor
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2
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LogD (pH = 5.5)
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-0.7348351
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LogD (pH = 7.4)
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-0.7348352
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Log P
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-0.7348351
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Molar Refractivity
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23.117 cm3
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Polarizability
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8.279875 Å3
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Polar Surface Area
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40.46 Å2
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Rotatable Bonds
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2
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Lipinski's Rule of Five
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true
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PATENTS
PATENTS
PubChem Patent
Google Patent