tributyl(thianthren-1-yl)stannane

C24H34S2Sn — CID 10839255

IUPACtributyl(thianthren-1-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1cccc2c1Sc1ccccc1S2
InChIInChI=1S/C12H7S2.3C4H9.Sn/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10;3*1-3-4-2;/h1-7H;3*1,3-4H2,2H3;
InChIKeyWQFSZSZZNSGNRS-UHFFFAOYSA-N
MW505.38 g/mol
LogP8.36
Rot. Bonds10

About tributyl(thianthren-1-yl)stannane

tributyl(thianthren-1-yl)stannane (PubChem CID 10839255) has the molecular formula C24H34S2Sn and a molecular weight of 505.38 g/mol. Its IUPAC name is tributyl(thianthren-1-yl)stannane.

Molecular Properties

Compound Nametributyl(thianthren-1-yl)stannane
PubChem CID10839255
Molecular FormulaC24H34S2Sn
Molecular Weight505.38 g/mol
Exact Mass506.11
IUPAC Nametributyl(thianthren-1-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1cccc2c1Sc1ccccc1S2
InChIInChI=1S/C12H7S2.3C4H9.Sn/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10;3*1-3-4-2;/h1-7H;3*1,3-4H2,2H3;
InChIKeyWQFSZSZZNSGNRS-UHFFFAOYSA-N
XLogP8.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500505.38
LogP ≤ 58.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

tributyl(2,3-dihydro-1H-inden-4-yl)stannane
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tributyl-(2-chloro-3-pyridinyl)stannane
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2-tributylstannylbenzohydrazide
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1,3-dibromoazulene;tributyl-(3-methylazulen-1-yl)stannane
CID 161202030
CID 160621349
CID 160621349
tributyl-[2-[(E)-2-(4-propan-2-yloxyphenyl)ethenyl]phenyl]stannane
CID 16638844
3-tributylstannylbenzo[b]phenalen-7-one
CID 10984149
(2-chloro-6-tributylstannylphenyl) N-propan-2-ylcarbamate
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10-butylphenothiazine;propane
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Frequently Asked Questions

What is the IUPAC name of tributyl(thianthren-1-yl)stannane?
The IUPAC name of tributyl(thianthren-1-yl)stannane (CID 10839255) is tributyl(thianthren-1-yl)stannane.
What is the SMILES notation for tributyl(thianthren-1-yl)stannane?
The canonical SMILES for tributyl(thianthren-1-yl)stannane is CCCC[Sn](CCCC)(CCCC)c1cccc2c1Sc1ccccc1S2.
What is the InChIKey of tributyl(thianthren-1-yl)stannane?
The InChIKey is WQFSZSZZNSGNRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7S2.3C4H9.Sn/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10;3*1-3-4-2;/h1-7H;3*1,3-4H2,2H3;.
What are the key properties of tributyl(thianthren-1-yl)stannane?
tributyl(thianthren-1-yl)stannane has a molecular weight of 505.38 g/mol, XLogP of 8.36, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(thianthren-1-yl)stannane is sourced from PubChem (CID 10839255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).