triethyl-[(E)-1-tributylstannyloct-1-enoxy]silane

C26H56OSiSn — CID 140517328

IUPACtriethyl-[(E)-1-tributylstannyloct-1-enoxy]silane
SMILESCCCCCC/C=C(\O[Si](CC)(CC)CC)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C14H29OSi.3C4H9.Sn/c1-5-9-10-11-12-13-14-15-16(6-2,7-3)8-4;3*1-3-4-2;/h13H,5-12H2,1-4H3;3*1,3-4H2,2H3;
InChIKeyBLRVMXCTJJQIOZ-UHFFFAOYSA-N
MW531.53 g/mol
LogP10.25
Rot. Bonds20

About triethyl-[(E)-1-tributylstannyloct-1-enoxy]silane

triethyl-[(E)-1-tributylstannyloct-1-enoxy]silane (PubChem CID 140517328) has the molecular formula C26H56OSiSn and a molecular weight of 531.53 g/mol. Its IUPAC name is triethyl-[(E)-1-tributylstannyloct-1-enoxy]silane.

Molecular Properties

Compound Nametriethyl-[(E)-1-tributylstannyloct-1-enoxy]silane
PubChem CID140517328
Molecular FormulaC26H56OSiSn
Molecular Weight531.53 g/mol
Exact Mass532.31
IUPAC Nametriethyl-[(E)-1-tributylstannyloct-1-enoxy]silane
SMILESCCCCCC/C=C(\O[Si](CC)(CC)CC)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C14H29OSi.3C4H9.Sn/c1-5-9-10-11-12-13-14-15-16(6-2,7-3)8-4;3*1-3-4-2;/h13H,5-12H2,1-4H3;3*1,3-4H2,2H3;
InChIKeyBLRVMXCTJJQIOZ-UHFFFAOYSA-N
XLogP10.25
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds20
Heavy Atoms29
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500531.53
LogP ≤ 510.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

trimethyl-[(E)-1-tributylstannyloct-1-enyl]silane
CID 177468758
undec-1-ene-1,1-diol
CID 87556705
tributyl-[(E)-1-butyltellanyloct-1-enyl]stannane
CID 10698547
1-chlorooctadec-1-en-1-amine
CID 173460084
tricos-1-ene-1,1-diamine
CID 141373485
trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane
CID 88765999
(E)-2-[(E)-pentadec-2-en-2-yl]oxypentadec-2-ene
CID 90470665
undec-3-en-3-amine
CID 151904505
trimethyl(tridec-6-en-7-yloxy)silane
CID 71373988
trimethyl-[(Z)-oct-2-en-2-yl]oxysilane
CID 11275679
tributyl-[(E)-1-phenylselanylhept-1-enyl]stannane
CID 15314212
1-hexadec-1-enoxyhexadec-1-ene
CID 57140599

Frequently Asked Questions

What is the IUPAC name of triethyl-[(E)-1-tributylstannyloct-1-enoxy]silane?
The IUPAC name of triethyl-[(E)-1-tributylstannyloct-1-enoxy]silane (CID 140517328) is triethyl-[(E)-1-tributylstannyloct-1-enoxy]silane.
What is the SMILES notation for triethyl-[(E)-1-tributylstannyloct-1-enoxy]silane?
The canonical SMILES for triethyl-[(E)-1-tributylstannyloct-1-enoxy]silane is CCCCCC/C=C(\O[Si](CC)(CC)CC)[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of triethyl-[(E)-1-tributylstannyloct-1-enoxy]silane?
The InChIKey is BLRVMXCTJJQIOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29OSi.3C4H9.Sn/c1-5-9-10-11-12-13-14-15-16(6-2,7-3)8-4;3*1-3-4-2;/h13H,5-12H2,1-4H3;3*1,3-4H2,2H3;.
What are the key properties of triethyl-[(E)-1-tributylstannyloct-1-enoxy]silane?
triethyl-[(E)-1-tributylstannyloct-1-enoxy]silane has a molecular weight of 531.53 g/mol, XLogP of 10.25, 20 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(E)-1-tributylstannyloct-1-enoxy]silane is sourced from PubChem (CID 140517328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).