[(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane

C17H40O2Si3 — CID 135061198

IUPAC[(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane
SMILESCC(C)=CCC[C@H](C)CC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C17H40O2Si3/c1-16(2)12-11-13-17(3)14-15-22(10,18-20(4,5)6)19-21(7,8)9/h12,17H,11,13-15H2,1-10H3/t17-/m0/s1
InChIKeyIZKGICOAZGCECH-KRWDZBQOSA-N
MW360.76 g/mol
LogP6.53
Rot. Bonds10

About [(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane

[(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane (PubChem CID 135061198) has the molecular formula C17H40O2Si3 and a molecular weight of 360.76 g/mol. Its IUPAC name is [(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane.

Molecular Properties

Compound Name[(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane
PubChem CID135061198
Molecular FormulaC17H40O2Si3
Molecular Weight360.76 g/mol
Exact Mass360.23
IUPAC Name[(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane
SMILESCC(C)=CCC[C@H](C)CC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C17H40O2Si3/c1-16(2)12-11-13-17(3)14-15-22(10,18-20(4,5)6)19-21(7,8)9/h12,17H,11,13-15H2,1-10H3/t17-/m0/s1
InChIKeyIZKGICOAZGCECH-KRWDZBQOSA-N
XLogP6.53
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.76
LogP ≤ 56.53
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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Frequently Asked Questions

What is the IUPAC name of [(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane?
The IUPAC name of [(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane (CID 135061198) is [(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane.
What is the SMILES notation for [(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane?
The canonical SMILES for [(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane is CC(C)=CCC[C@H](C)CC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of [(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane?
The InChIKey is IZKGICOAZGCECH-KRWDZBQOSA-N. The full InChI is InChI=1S/C17H40O2Si3/c1-16(2)12-11-13-17(3)14-15-22(10,18-20(4,5)6)19-21(7,8)9/h12,17H,11,13-15H2,1-10H3/t17-/m0/s1.
What are the key properties of [(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane?
[(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane has a molecular weight of 360.76 g/mol, XLogP of 6.53, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-3,7-dimethyloct-6-enyl]-methyl-bis(trimethylsilyloxy)silane is sourced from PubChem (CID 135061198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).