trimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane

C28H58OSiSn — CID 88766804

IUPACtrimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane
SMILESCC=CC(C/C=C/[Sn](CCCC)(CCCC)CCCC)(CCCCCC)O[Si](C)(C)C
InChIInChI=1S/C16H31OSi.3C4H9.Sn/c1-7-10-11-12-15-16(13-8-2,14-9-3)17-18(4,5)6;3*1-3-4-2;/h2,8-9,14H,7,10-13,15H2,1,3-6H3;3*1,3-4H2,2H3;
InChIKeyYJERRWZLCQIHSL-UHFFFAOYSA-N
MW557.57 g/mol
LogP10.46
Rot. Bonds20

About trimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane

trimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane (PubChem CID 88766804) has the molecular formula C28H58OSiSn and a molecular weight of 557.57 g/mol. Its IUPAC name is trimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane
PubChem CID88766804
Molecular FormulaC28H58OSiSn
Molecular Weight557.57 g/mol
Exact Mass558.33
IUPAC Nametrimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane
SMILESCC=CC(C/C=C/[Sn](CCCC)(CCCC)CCCC)(CCCCCC)O[Si](C)(C)C
InChIInChI=1S/C16H31OSi.3C4H9.Sn/c1-7-10-11-12-15-16(13-8-2,14-9-3)17-18(4,5)6;3*1-3-4-2;/h2,8-9,14H,7,10-13,15H2,1,3-6H3;3*1,3-4H2,2H3;
InChIKeyYJERRWZLCQIHSL-UHFFFAOYSA-N
XLogP10.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds20
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500557.57
LogP ≤ 510.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane?
The IUPAC name of trimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane (CID 88766804) is trimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane.
What is the SMILES notation for trimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane?
The canonical SMILES for trimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane is CC=CC(C/C=C/[Sn](CCCC)(CCCC)CCCC)(CCCCCC)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane?
The InChIKey is YJERRWZLCQIHSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31OSi.3C4H9.Sn/c1-7-10-11-12-15-16(13-8-2,14-9-3)17-18(4,5)6;3*1-3-4-2;/h2,8-9,14H,7,10-13,15H2,1,3-6H3;3*1,3-4H2,2H3;.
What are the key properties of trimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane?
trimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane has a molecular weight of 557.57 g/mol, XLogP of 10.46, 20 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-4-prop-1-enyl-1-tributylstannyldec-1-en-4-yl]oxysilane is sourced from PubChem (CID 88766804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).