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535924-69-7 molecular structure
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tributyl(3,6-dihydro-2H-pyran-4-yl)stannane

ChemBase ID: 65209
Molecular Formular: C17H34OSn
Molecular Mass: 373.15226
Monoisotopic Mass: 374.16315971
SMILES and InChIs

SMILES:
C1OCC=C(C1)[Sn](CCCC)(CCCC)CCCC
Canonical SMILES:
CCCC[Sn](C1=CCOCC1)(CCCC)CCCC
InChI:
InChI=1S/C5H7O.3C4H9.Sn/c1-2-4-6-5-3-1;3*1-3-4-2;/h2H,3-5H2;3*1,3-4H2,2H3;
InChIKey:
DQPBQTZZZCVCLD-UHFFFAOYSA-N

Cite this record

CBID:65209 http://www.chembase.cn/molecule-65209.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tributyl(3,6-dihydro-2H-pyran-4-yl)stannane
IUPAC Traditional name
tributyl(3,6-dihydro-2H-pyran-4-yl)stannane
Synonyms
4-Tributylstannyl-3,6-dihydro-2H-pyran
CAS Number
535924-69-7
MDL Number
MFCD18325166
PubChem SID
162030948
PubChem CID
22252258

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 22252258 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 5.8134  LogD (pH = 7.4) 5.8134 
Log P 5.8134  Molar Refractivity 83.9709 cm3
Polarizability 37.0847 Å3 Polar Surface Area 9.23 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
92% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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