(Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol

C24H50OSiSn — CID 10458683

IUPAC(Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol
SMILESCCCC[Sn](CCCC)(CCCC)/C(=C\C(O)C1CCCCC1)[Si](C)(C)C
InChIInChI=1S/C12H23OSi.3C4H9.Sn/c1-14(2,3)10-9-12(13)11-7-5-4-6-8-11;3*1-3-4-2;/h9,11-13H,4-8H2,1-3H3;3*1,3-4H2,2H3;
InChIKeyBKQQNMXZXLZMBK-UHFFFAOYSA-N
MW501.46 g/mol
LogP8.12
Rot. Bonds13

About (Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol

(Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol (PubChem CID 10458683) has the molecular formula C24H50OSiSn and a molecular weight of 501.46 g/mol. Its IUPAC name is (Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol.

Molecular Properties

Compound Name(Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol
PubChem CID10458683
Molecular FormulaC24H50OSiSn
Molecular Weight501.46 g/mol
Exact Mass502.27
IUPAC Name(Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol
SMILESCCCC[Sn](CCCC)(CCCC)/C(=C\C(O)C1CCCCC1)[Si](C)(C)C
InChIInChI=1S/C12H23OSi.3C4H9.Sn/c1-14(2,3)10-9-12(13)11-7-5-4-6-8-11;3*1-3-4-2;/h9,11-13H,4-8H2,1-3H3;3*1,3-4H2,2H3;
InChIKeyBKQQNMXZXLZMBK-UHFFFAOYSA-N
XLogP8.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms27
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500501.46
LogP ≤ 58.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol?
The IUPAC name of (Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol (CID 10458683) is (Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol.
What is the SMILES notation for (Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol?
The canonical SMILES for (Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol is CCCC[Sn](CCCC)(CCCC)/C(=C\C(O)C1CCCCC1)[Si](C)(C)C.
What is the InChIKey of (Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol?
The InChIKey is BKQQNMXZXLZMBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23OSi.3C4H9.Sn/c1-14(2,3)10-9-12(13)11-7-5-4-6-8-11;3*1-3-4-2;/h9,11-13H,4-8H2,1-3H3;3*1,3-4H2,2H3;.
What are the key properties of (Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol?
(Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol has a molecular weight of 501.46 g/mol, XLogP of 8.12, 13 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol is sourced from PubChem (CID 10458683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).