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26274-35-1 molecular structure
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2,4-diphenylpyridine

ChemBase ID: 294147
Molecular Formular: C17H13N
Molecular Mass: 231.29182
Monoisotopic Mass: 231.10479942
SMILES and InChIs

SMILES:
c1(c2ccccc2)nccc(c2ccccc2)c1
Canonical SMILES:
c1ccc(cc1)c1ccnc(c1)c1ccccc1
InChI:
InChI=1S/C17H13N/c1-3-7-14(8-4-1)16-11-12-18-17(13-16)15-9-5-2-6-10-15/h1-13H
InChIKey:
YASXBDJBCBUIHT-UHFFFAOYSA-N

Cite this record

CBID:294147 http://www.chembase.cn/molecule-294147.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2,4-diphenylpyridine
IUPAC Traditional name
2,4-diphenylpyridine
Synonyms
2,4-Diphenylpyridine
CAS Number
26274-35-1
MDL Number
MFCD00972966
PubChem SID
180679678
PubChem CID
42014

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 42014 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 4.400955  LogD (pH = 7.4) 4.4354157 
Log P 4.4358745  Molar Refractivity 73.8015 cm3
Polarizability 31.686068 Å3 Polar Surface Area 12.89 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
95+% expand Show data source
98% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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