tert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane

C15H32OSi — CID 162624079

IUPACtert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane
SMILESC/C=C\CC[C@H](C)CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H32OSi/c1-8-9-10-11-14(2)12-13-16-17(6,7)15(3,4)5/h8-9,14H,10-13H2,1-7H3/b9-8-/t14-/m0/s1
InChIKeyHRCHSENGRZRQJU-CKXPSTMWSA-N
MW256.51 g/mol
LogP5.39
Rot. Bonds7

About tert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane

tert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane (PubChem CID 162624079) has the molecular formula C15H32OSi and a molecular weight of 256.51 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane
PubChem CID162624079
Molecular FormulaC15H32OSi
Molecular Weight256.51 g/mol
Exact Mass256.22
IUPAC Nametert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane
SMILESC/C=C\CC[C@H](C)CCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H32OSi/c1-8-9-10-11-14(2)12-13-16-17(6,7)15(3,4)5/h8-9,14H,10-13H2,1-7H3/b9-8-/t14-/m0/s1
InChIKeyHRCHSENGRZRQJU-CKXPSTMWSA-N
XLogP5.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.51
LogP ≤ 55.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

[2-(3-Cyclohexenyl)ethyl]triethoxysilane
CID 11300254
Silane, [(3,7-dimethyl-6-octenyl)oxy]trimethyl-
CID 557338
tert-butyl-dimethyl-[(2R,3R)-2,3,6-trimethylhept-5-enoxy]silane
CID 154722229
tert-butyl-dimethyl-[(1S,6S)-6-prop-2-enylcyclohex-3-en-1-yl]oxysilane
CID 11543369
Tert-butyl-(1-cyclopent-3-en-1-ylbut-3-enoxy)-dimethylsilane
CID 11666003
(S)-tert-butyl((3,7-dimethyloct-6-en-1-yl)oxy)dimethylsilane
CID 22882877
tert-butyl-dimethyl-[(1S,6R)-6-prop-2-enylcyclohex-3-en-1-yl]oxysilane
CID 134979966
beta-Citronellol, TBDMS derivative
CID 11043851
bis[(3,7-Dimethyloct-6-en-1-yl)oxy](dimethyl)silane
CID 91697684
Silane, dimethyl(non-3-enyloxy)isohexyloxy-
CID 91698241
1,2,3,6-Tetrahydrobenzylalcohol, tert-butyldimethylsilyl ether
CID 11229886
3,7-Dimethyloct-6-enoxy(triethyl)silane
CID 72751260

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane (CID 162624079) is tert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane is C/C=C\CC[C@H](C)CCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane?
The InChIKey is HRCHSENGRZRQJU-CKXPSTMWSA-N. The full InChI is InChI=1S/C15H32OSi/c1-8-9-10-11-14(2)12-13-16-17(6,7)15(3,4)5/h8-9,14H,10-13H2,1-7H3/b9-8-/t14-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane?
tert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane has a molecular weight of 256.51 g/mol, XLogP of 5.39, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(Z,3S)-3-methyloct-6-enoxy]silane is sourced from PubChem (CID 162624079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).