trimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane

C19H34OSSi2 — CID 11132308

IUPACtrimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane
SMILESC=C(CC(CCSc1ccccc1)O[Si](C)(C)C)C[Si](C)(C)C
InChIInChI=1S/C19H34OSSi2/c1-17(16-22(2,3)4)15-18(20-23(5,6)7)13-14-21-19-11-9-8-10-12-19/h8-12,18H,1,13-16H2,2-7H3
InChIKeyNQMWZEJMISSEHG-UHFFFAOYSA-N
MW366.72 g/mol
LogP6.67
Rot. Bonds10

About trimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane

trimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane (PubChem CID 11132308) has the molecular formula C19H34OSSi2 and a molecular weight of 366.72 g/mol. Its IUPAC name is trimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane.

Molecular Properties

Compound Nametrimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane
PubChem CID11132308
Molecular FormulaC19H34OSSi2
Molecular Weight366.72 g/mol
Exact Mass366.19
IUPAC Nametrimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane
SMILESC=C(CC(CCSc1ccccc1)O[Si](C)(C)C)C[Si](C)(C)C
InChIInChI=1S/C19H34OSSi2/c1-17(16-22(2,3)4)15-18(20-23(5,6)7)13-14-21-19-11-9-8-10-12-19/h8-12,18H,1,13-16H2,2-7H3
InChIKeyNQMWZEJMISSEHG-UHFFFAOYSA-N
XLogP6.67
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.72
LogP ≤ 56.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Silane, trimethyl[2-(phenylthio)ethoxy]-
CID 553448
[(1R,2R)-2-[(E)-2-(benzenesulfonyl)ethenyl]cyclopropyl]oxy-tert-butyl-dimethylsilane
CID 11602512
Triethoxy(2-phenylsulfanylethyl)silane
CID 13932527
3-(t-Butyldi-methylsiloxy)-1-butenyl phenyl sulfide
CID 67779864
(r)-3-(t-Butyldimethylsilanyloxy)butyl phenylsulfide
CID 101617074
Triethoxy(3-phenylsulfanylpropyl)silane
CID 151300368
(2-Fluoro-2-phenylsulfanylethoxy)-trimethylsilane
CID 151615759
(1-Fluoro-2-phenylsulfanylethoxy)-trimethylsilane
CID 164806355
tert-Butyl(dimethyl)[(phenylsulfanyl)methoxy]silane
CID 13352514
tert-butyl-dimethyl-[(E)-4-phenylsulfanylbut-3-enoxy]silane
CID 10637592
[(E)-2,4-dimethyl-5-phenylsulfanylpent-3-enoxy]-trimethylsilane
CID 10946332
tert-butyl-dimethyl-[(Z,2R)-4-phenylsulfanylbut-3-en-2-yl]oxysilane
CID 10990080

Frequently Asked Questions

What is the IUPAC name of trimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane?
The IUPAC name of trimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane (CID 11132308) is trimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane.
What is the SMILES notation for trimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane?
The canonical SMILES for trimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane is C=C(CC(CCSc1ccccc1)O[Si](C)(C)C)C[Si](C)(C)C.
What is the InChIKey of trimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane?
The InChIKey is NQMWZEJMISSEHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34OSSi2/c1-17(16-22(2,3)4)15-18(20-23(5,6)7)13-14-21-19-11-9-8-10-12-19/h8-12,18H,1,13-16H2,2-7H3.
What are the key properties of trimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane?
trimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane has a molecular weight of 366.72 g/mol, XLogP of 6.67, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(2-methylidene-6-phenylsulfanyl-4-trimethylsilyloxyhexyl)silane is sourced from PubChem (CID 11132308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).