triethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane

C14H29IOSi — CID 91188143

IUPACtriethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane
SMILESCCCCC[C@@H](C=CI)O[Si](CC)(CC)CC
InChIInChI=1S/C14H29IOSi/c1-5-9-10-11-14(12-13-15)16-17(6-2,7-3)8-4/h12-14H,5-11H2,1-4H3/t14-/m0/s1
InChIKeyFXAKXZZXICYUQV-AWEZNQCLSA-N
MW368.38 g/mol
LogP5.91
Rot. Bonds10

About triethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane

triethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane (PubChem CID 91188143) has the molecular formula C14H29IOSi and a molecular weight of 368.38 g/mol. Its IUPAC name is triethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane.

Molecular Properties

Compound Nametriethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane
PubChem CID91188143
Molecular FormulaC14H29IOSi
Molecular Weight368.38 g/mol
Exact Mass368.10
IUPAC Nametriethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane
SMILESCCCCC[C@@H](C=CI)O[Si](CC)(CC)CC
InChIInChI=1S/C14H29IOSi/c1-5-9-10-11-14(12-13-15)16-17(6-2,7-3)8-4/h12-14H,5-11H2,1-4H3/t14-/m0/s1
InChIKeyFXAKXZZXICYUQV-AWEZNQCLSA-N
XLogP5.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.38
LogP ≤ 55.91
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': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of triethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane?
The IUPAC name of triethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane (CID 91188143) is triethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane.
What is the SMILES notation for triethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane?
The canonical SMILES for triethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane is CCCCC[C@@H](C=CI)O[Si](CC)(CC)CC.
What is the InChIKey of triethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane?
The InChIKey is FXAKXZZXICYUQV-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H29IOSi/c1-5-9-10-11-14(12-13-15)16-17(6-2,7-3)8-4/h12-14H,5-11H2,1-4H3/t14-/m0/s1.
What are the key properties of triethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane?
triethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane has a molecular weight of 368.38 g/mol, XLogP of 5.91, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(3S)-1-iodooct-1-en-3-yl]oxysilane is sourced from PubChem (CID 91188143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).