NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-(tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline
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IUPAC Traditional name
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4-(tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline
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Synonyms
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4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)isoquinoline
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4-Isoquinolineboronic acid pinacol ester
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4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)ISOQUINOLINE
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4-(4,4,5,5-四甲基-1,3,2-二氧杂硼烷-2-基)异喹啉
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4-异喹啉硼酸频哪醇酯
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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
H Acceptors
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3
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H Donor
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0
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LogD (pH = 5.5)
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3.5713043
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LogD (pH = 7.4)
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3.5904493
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Log P
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3.5907
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Molar Refractivity
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70.0064 cm3
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Polarizability
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30.666101 Å3
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Polar Surface Area
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31.35 Å2
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Rotatable Bonds
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1
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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