NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-tert-butyl 2-methyl 4-bromo-1H-pyrrole-1,2-dicarboxylate
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IUPAC Traditional name
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1-tert-butyl 2-methyl 4-bromopyrrole-1,2-dicarboxylate
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Synonyms
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1-(tert-Butyl) 2-methyl 4-bromo-1H-pyrrole-1,2-dicarboxylate
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Methyl 4-bromo-1H-pyrrole-2-carboxylate, N-BOC protected
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1-(tert-Butyl) 2-methyl 4-bromo-1H-pyrrole-1,2-dicarboxylate
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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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2
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H Donor
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0
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LogD (pH = 5.5)
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2.7384205
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LogD (pH = 7.4)
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2.7384205
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Log P
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2.7384205
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Molar Refractivity
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65.0419 cm3
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Polarizability
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25.414906 Å3
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Polar Surface Area
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57.53 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