NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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3-(6-bromo-4-oxo-4H-chromen-3-yl)propanoic acid
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IUPAC Traditional name
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3-(6-bromo-4-oxochromen-3-yl)propanoic acid
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Synonyms
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6-Bromochromone-3-propionic acid
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6-溴色酮-3-丙酸
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CAS 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
Acid pKa
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3.0079112
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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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-0.052681528
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LogD (pH = 7.4)
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-1.0709661
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Log P
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2.4026792
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Molar Refractivity
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64.1354 cm3
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Polarizability
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24.611202 Å3
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Polar Surface Area
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63.6 Å2
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Rotatable Bonds
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3
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Lipinski's Rule of Five
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true
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DETAILS
DETAILS
Sigma Aldrich
PATENTS
PATENTS
PubChem Patent
Google Patent