Home > Compound List > Compound details
850349-02-9 molecular structure
click picture or here to close

8-bromoimidazo[1,2-a]pyridine

ChemBase ID: 51447
Molecular Formular: C7H5BrN2
Molecular Mass: 197.032
Monoisotopic Mass: 195.96361017
SMILES and InChIs

SMILES:
c12c(cccn1ccn2)Br
Canonical SMILES:
Brc1cccn2c1ncc2
InChI:
InChI=1S/C7H5BrN2/c8-6-2-1-4-10-5-3-9-7(6)10/h1-5H
InChIKey:
GCCVNNZARPFXES-UHFFFAOYSA-N

Cite this record

CBID:51447 http://www.chembase.cn/molecule-51447.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
8-bromoimidazo[1,2-a]pyridine
IUPAC Traditional name
8-bromoimidazo[1,2-a]pyridine
Synonyms
8-Bromoimidazo[1,2-a]pyridine
CAS Number
850349-02-9
MDL Number
MFCD08706060
PubChem SID
162056210
PubChem CID
17749933

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.1279685  LogD (pH = 7.4) 1.5188092 
Log P 1.5283021  Molar Refractivity 43.5592 cm3
Polarizability 16.13238 Å3 Polar Surface Area 17.3 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
Storage Warning
Harmful/Irritant expand Show data source
IRRITANT expand Show data source
MSDS Link
Download expand Show data source
TSCA Listed
false expand Show data source
Purity
95% expand Show data source
97% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle