5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin

C18H32OSSn — CID 141423609

IUPAC5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin
SMILESCCCCC(CCCC)(CCCC)[Sn]c1sccc1OC
InChIInChI=1S/C13H27.C5H5OS.Sn/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-6-5-2-3-7-4-5;/h4-12H2,1-3H3;2-3H,1H3;
InChIKeyRSWHMBKQNVJVBP-UHFFFAOYSA-N
MW415.23 g/mol
LogP5.82
Rot. Bonds12

About 5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin

5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin (PubChem CID 141423609) has the molecular formula C18H32OSSn and a molecular weight of 415.23 g/mol. Its IUPAC name is 5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin.

Molecular Properties

Compound Name5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin
PubChem CID141423609
Molecular FormulaC18H32OSSn
Molecular Weight415.23 g/mol
Exact Mass416.12
IUPAC Name5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin
SMILESCCCCC(CCCC)(CCCC)[Sn]c1sccc1OC
InChIInChI=1S/C13H27.C5H5OS.Sn/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-6-5-2-3-7-4-5;/h4-12H2,1-3H3;2-3H,1H3;
InChIKeyRSWHMBKQNVJVBP-UHFFFAOYSA-N
XLogP5.82
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.23
LogP ≤ 55.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-butylnonan-5-yl-[3-(1,3-dioxol-2-yl)thiophen-2-yl]tin
CID 140986624
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5-butylnonan-5-yl-(2,6-dimethoxypyrimidin-4-yl)tin
CID 140989750
5-butylnonan-5-yl-(4-methoxy-2-pyridinyl)tin
CID 141269215
5-(3,4-dimethoxyphenyl)nonan-5-amine;hydrochloride
CID 3032230
1-(3-methoxythiophen-2-yl)decan-1-ol
CID 115782906
2-bromo-3-butoxythiophene
CID 90107659
1-(3-methoxythiophen-2-yl)nonylhydrazine
CID 105294508
3-methoxy-2-(3-methoxythiophen-2-yl)thiophene
CID 10609306
5-butylnonan-5-yl-(3,6-dimethoxypyridazin-4-yl)tin
CID 141228722
5-butylnonan-5-yl(1,2-oxazol-5-yl)tin
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1-methoxy-4-[2-(4-methoxy-3-methylphenyl)decan-2-yl]-2-methylbenzene
CID 171057442

Frequently Asked Questions

What is the IUPAC name of 5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin?
The IUPAC name of 5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin (CID 141423609) is 5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin.
What is the SMILES notation for 5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin?
The canonical SMILES for 5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin is CCCCC(CCCC)(CCCC)[Sn]c1sccc1OC.
What is the InChIKey of 5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin?
The InChIKey is RSWHMBKQNVJVBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27.C5H5OS.Sn/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-6-5-2-3-7-4-5;/h4-12H2,1-3H3;2-3H,1H3;.
What are the key properties of 5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin?
5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin has a molecular weight of 415.23 g/mol, XLogP of 5.82, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butylnonan-5-yl-(3-methoxythiophen-2-yl)tin is sourced from PubChem (CID 141423609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).