Home > Compound List > Compound details
23309-74-2 molecular structure
click picture or here to close

2,3-bis(pyridin-2-yl)quinoxaline

ChemBase ID: 112428
Molecular Formular: C18H12N4
Molecular Mass: 284.31468
Monoisotopic Mass: 284.1061964
SMILES and InChIs

SMILES:
c1ccc(nc1)c1nc2ccccc2nc1c1ccccn1
Canonical SMILES:
c1ccc(nc1)c1nc2ccccc2nc1c1ccccn1
InChI:
InChI=1S/C18H12N4/c1-2-8-14-13(7-1)21-17(15-9-3-5-11-19-15)18(22-14)16-10-4-6-12-20-16/h1-12H
InChIKey:
ILLTYNYTHFEGHK-UHFFFAOYSA-N

Cite this record

CBID:112428 http://www.chembase.cn/molecule-112428.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2,3-bis(pyridin-2-yl)quinoxaline
IUPAC Traditional name
2,3-bis(pyridin-2-yl)quinoxaline
Synonyms
2,3-bis(2-PYRIDYL)QUINOXALINE
CAS Number
23309-74-2
PubChem SID
162098187
PubChem CID
97023

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
MP Biomedicals
05223883 external link Add to cart Please log in.
Data Source Data ID
PubChem 97023 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 3.7008204  LogD (pH = 7.4) 3.701576 
Log P 3.7015855  Molar Refractivity 81.921 cm3
Polarizability 36.43046 Å3 Polar Surface Area 51.56 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
MSDS Link
Download expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05223883 external link
MP Biomedicals Rare Chemical collection

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