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1214374-67-0 molecular structure
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3-fluoro-5-phenylpyridine

ChemBase ID: 290797
Molecular Formular: C11H8FN
Molecular Mass: 173.1863232
Monoisotopic Mass: 173.06407748
SMILES and InChIs

SMILES:
Fc1cc(c2ccccc2)cnc1
Canonical SMILES:
Fc1cncc(c1)c1ccccc1
InChI:
InChI=1S/C11H8FN/c12-11-6-10(7-13-8-11)9-4-2-1-3-5-9/h1-8H
InChIKey:
PCPOYBUASKBNLM-UHFFFAOYSA-N

Cite this record

CBID:290797 http://www.chembase.cn/molecule-290797.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
3-fluoro-5-phenylpyridine
IUPAC Traditional name
3-fluoro-5-phenylpyridine
Synonyms
3-Fluoro-5-phenylpyridine
CAS Number
1214374-67-0
PubChem SID
180676328
PubChem CID
46314933

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Bide Pharmatech
BD230183 Please log in.
Data Source Data ID
PubChem 46314933 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.5452478  LogD (pH = 7.4) 2.5454974 
Log P 2.5455008  Molar Refractivity 49.2537 cm3
Polarizability 20.050909 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

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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