[(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane

C14H22O2SSi — CID 11033338

IUPAC[(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane
SMILESCCS/C(=C\OCc1ccccc1)O[Si](C)(C)C
InChIInChI=1S/C14H22O2SSi/c1-5-17-14(16-18(2,3)4)12-15-11-13-9-7-6-8-10-13/h6-10,12H,5,11H2,1-4H3/b14-12-
InChIKeySECHNQCWXAVLCV-OWBHPGMISA-N
MW282.48 g/mol
LogP4.61
Rot. Bonds7

About [(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane

[(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane (PubChem CID 11033338) has the molecular formula C14H22O2SSi and a molecular weight of 282.48 g/mol. Its IUPAC name is [(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane.

Molecular Properties

Compound Name[(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane
PubChem CID11033338
Molecular FormulaC14H22O2SSi
Molecular Weight282.48 g/mol
Exact Mass282.11
IUPAC Name[(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane
SMILESCCS/C(=C\OCc1ccccc1)O[Si](C)(C)C
InChIInChI=1S/C14H22O2SSi/c1-5-17-14(16-18(2,3)4)12-15-11-13-9-7-6-8-10-13/h6-10,12H,5,11H2,1-4H3/b14-12-
InChIKeySECHNQCWXAVLCV-OWBHPGMISA-N
XLogP4.61
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.48
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane?
The IUPAC name of [(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane (CID 11033338) is [(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane.
What is the SMILES notation for [(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane?
The canonical SMILES for [(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane is CCS/C(=C\OCc1ccccc1)O[Si](C)(C)C.
What is the InChIKey of [(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane?
The InChIKey is SECHNQCWXAVLCV-OWBHPGMISA-N. The full InChI is InChI=1S/C14H22O2SSi/c1-5-17-14(16-18(2,3)4)12-15-11-13-9-7-6-8-10-13/h6-10,12H,5,11H2,1-4H3/b14-12-.
What are the key properties of [(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane?
[(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane has a molecular weight of 282.48 g/mol, XLogP of 4.61, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-1-ethylsulfanyl-2-phenylmethoxyethenoxy]-trimethylsilane is sourced from PubChem (CID 11033338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).