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1204580-73-3 molecular structure
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2-chloro-4-(tributylstannyl)pyridine

ChemBase ID: 64386
Molecular Formular: C17H30ClNSn
Molecular Mass: 402.5808
Monoisotopic Mass: 403.10887165
SMILES and InChIs

SMILES:
c1c([Sn](CCCC)(CCCC)CCCC)ccnc1Cl
Canonical SMILES:
CCCC[Sn](c1ccnc(c1)Cl)(CCCC)CCCC
InChI:
InChI=1S/C5H3ClN.3C4H9.Sn/c6-5-3-1-2-4-7-5;3*1-3-4-2;/h2-4H;3*1,3-4H2,2H3;
InChIKey:
VYPKIZMQUATPKJ-UHFFFAOYSA-N

Cite this record

CBID:64386 http://www.chembase.cn/molecule-64386.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-chloro-4-(tributylstannyl)pyridine
IUPAC Traditional name
2-chloro-4-(tributylstannyl)pyridine
Synonyms
2-Chloro-4-(tributylstannyl)pyridine
CAS Number
1204580-73-3
MDL Number
MFCD10699154
PubChem SID
162030125
PubChem CID
19959059

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Matrix Scientific
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Data Source Data ID
PubChem 19959059 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 4.707677  LogD (pH = 7.4) 4.7077 
Log P 4.7077  Molar Refractivity 87.5992 cm3
Polarizability 38.80987 Å3 Polar Surface Area 12.89 Å2
Rotatable Bonds 10  Lipinski's Rule of Five true 

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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