Home > Compound List > Compound details
MFCD05177252 molecular structure
click picture or here to close

2-(2-methoxyphenyl)imidazo[1,2-a]pyridine-3-carbaldehyde

ChemBase ID: 35292
Molecular Formular: C15H12N2O2
Molecular Mass: 252.26798
Monoisotopic Mass: 252.08987763
SMILES and InChIs

SMILES:
c1(nc2n(c1C=O)cccc2)c1c(OC)cccc1
Canonical SMILES:
COc1ccccc1c1nc2n(c1C=O)cccc2
InChI:
InChI=1S/C15H12N2O2/c1-19-13-7-3-2-6-11(13)15-12(10-18)17-9-5-4-8-14(17)16-15/h2-10H,1H3
InChIKey:
BNZXWEJQRXRXSZ-UHFFFAOYSA-N

Cite this record

CBID:35292 http://www.chembase.cn/molecule-35292.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-(2-methoxyphenyl)imidazo[1,2-a]pyridine-3-carbaldehyde
IUPAC Traditional name
2-(2-methoxyphenyl)imidazo[1,2-a]pyridine-3-carbaldehyde
Synonyms
2-(2-Methoxyphenyl)imidazo[1,2-a]pyridine-3-carbaldehyde
MDL Number
MFCD05177252
PubChem SID
160998599
PubChem CID
16767585

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Matrix Scientific
038065 external link Add to cart Please log in.
Data Source Data ID
PubChem 16767585 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.2529652  LogD (pH = 7.4) 2.2672718 
Log P 2.2674572  Molar Refractivity 73.6253 cm3
Polarizability 28.676075 Å3 Polar Surface Area 43.6 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Bioassay(PubChem)
Storage Warning
IRRITANT expand Show data source
MSDS Link
Download expand Show data source
TSCA Listed
false 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