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206357-78-0 molecular structure
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3-chloro-2-(tributylstannyl)pyridine

ChemBase ID: 64389
Molecular Formular: C17H30ClNSn
Molecular Mass: 402.5808
Monoisotopic Mass: 403.10887165
SMILES and InChIs

SMILES:
c1([Sn](CCCC)(CCCC)CCCC)ncccc1Cl
Canonical SMILES:
CCCC[Sn](c1ncccc1Cl)(CCCC)CCCC
InChI:
InChI=1S/C5H3ClN.3C4H9.Sn/c6-5-2-1-3-7-4-5;3*1-3-4-2;/h1-3H;3*1,3-4H2,2H3;
InChIKey:
UPSIWQDIUJUACS-UHFFFAOYSA-N

Cite this record

CBID:64389 http://www.chembase.cn/molecule-64389.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
3-chloro-2-(tributylstannyl)pyridine
IUPAC Traditional name
3-chloro-2-(tributylstannyl)pyridine
Synonyms
3-Chloro-2-(tributylstannyl)pyridine
CAS Number
206357-78-0
MDL Number
MFCD10699157
PubChem SID
162030128
PubChem CID
44118229

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Matrix Scientific
069715 external link Add to cart Please log in.
Data Source Data ID
PubChem 44118229 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 5.005034  LogD (pH = 7.4) 5.035201 
Log P 5.0356  Molar Refractivity 86.8514 cm3
Polarizability 38.75997 Å3 Polar Surface Area 12.89 Å2
Rotatable Bonds 10  Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

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

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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