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909720-21-4 molecular structure
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2,3-dibromo-6-methoxypyridine

ChemBase ID: 294793
Molecular Formular: C6H5Br2NO
Molecular Mass: 266.918
Monoisotopic Mass: 264.87378779
SMILES and InChIs

SMILES:
COc1ccc(Br)c(Br)n1
Canonical SMILES:
COc1ccc(c(n1)Br)Br
InChI:
InChI=1S/C6H5Br2NO/c1-10-5-3-2-4(7)6(8)9-5/h2-3H,1H3
InChIKey:
RBJHXRAOMXXAMS-UHFFFAOYSA-N

Cite this record

CBID:294793 http://www.chembase.cn/molecule-294793.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2,3-dibromo-6-methoxypyridine
IUPAC Traditional name
2,3-dibromo-6-methoxypyridine
Synonyms
2,3-Dibromo-6-methoxypyridine
CAS Number
909720-21-4
MDL Number
MFCD21648443
PubChem SID
180680324
PubChem CID
59389317

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Bide Pharmatech
BD237110 Please log in.
Data Source Data ID
PubChem 59389317 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.935387  LogD (pH = 7.4) 2.935387 
Log P 2.935387  Molar Refractivity 46.7656 cm3
Polarizability 18.041477 Å3 Polar Surface Area 22.12 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
95+% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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