chloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane

C15H27ClOSi — CID 91735032

IUPACchloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane
SMILESC=C(C)C#CC(O[Si](Cl)(CC)CC)C(C)CCC
InChIInChI=1S/C15H27ClOSi/c1-7-10-14(6)15(12-11-13(4)5)17-18(16,8-2)9-3/h14-15H,4,7-10H2,1-3,5-6H3
InChIKeyMUHRBGAYVLUHSG-UHFFFAOYSA-N
MW286.92 g/mol
LogP5.11
Rot. Bonds7

About chloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane

chloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane (PubChem CID 91735032) has the molecular formula C15H27ClOSi and a molecular weight of 286.92 g/mol. Its IUPAC name is chloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane.

Molecular Properties

Compound Namechloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane
PubChem CID91735032
Molecular FormulaC15H27ClOSi
Molecular Weight286.92 g/mol
Exact Mass286.15
IUPAC Namechloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane
SMILESC=C(C)C#CC(O[Si](Cl)(CC)CC)C(C)CCC
InChIInChI=1S/C15H27ClOSi/c1-7-10-14(6)15(12-11-13(4)5)17-18(16,8-2)9-3/h14-15H,4,7-10H2,1-3,5-6H3
InChIKeyMUHRBGAYVLUHSG-UHFFFAOYSA-N
XLogP5.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.92
LogP ≤ 55.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

5-Butyldimethylsilyloxy-2,6-dimethylnon-1-en-3-yne
CID 531330
5-(Dichloromethyl)dimethylsilyloxy-2,6-dimethylnon-1-en-3-yne
CID 531254
2,6-Dimethyl-5-triisobutylsilyloxynon-1-en-3-yne
CID 531265
2,7-Dimethyl-4-trimethylsilyloxyoct-7-en-5-yne
CID 531271
2,6-Dimethyl-5-trimethylsilyloxynon-1-en-3-yne
CID 531272
2,7-Dimethyl-4-dimethylisopropylsilyloxyoct-7-en-5-yne
CID 531290
2,6-Dimethyl-6-dimethylisopropylsilyloxynon-1-en-3-yne
CID 531291
2,6-Dimethyl-5-dimethyloctylsilyloxynon-1-en-3-yne
CID 531299
2,6-Dimethyl-5-tripropylsilyloxynon-1-en-3-yne
CID 531309
2,7-Dimethyl-4-trihexylsilyloxyoct-7-en-5-yne
CID 531319
2,6-Dimethyl-5-trihehylsilyloxynon-1-en-3-yne
CID 531320
4-Butyldimethylsilyloxy-2,7-dimethyloct-7-en-5-yne
CID 531329

Frequently Asked Questions

What is the IUPAC name of chloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane?
The IUPAC name of chloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane (CID 91735032) is chloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane.
What is the SMILES notation for chloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane?
The canonical SMILES for chloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane is C=C(C)C#CC(O[Si](Cl)(CC)CC)C(C)CCC.
What is the InChIKey of chloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane?
The InChIKey is MUHRBGAYVLUHSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27ClOSi/c1-7-10-14(6)15(12-11-13(4)5)17-18(16,8-2)9-3/h14-15H,4,7-10H2,1-3,5-6H3.
What are the key properties of chloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane?
chloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane has a molecular weight of 286.92 g/mol, XLogP of 5.11, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(2,6-dimethylnon-1-en-3-yn-5-yloxy)-diethylsilane is sourced from PubChem (CID 91735032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).