[(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane

C12H26O2Si — CID 101062840

IUPAC[(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane
SMILESCCO[C@]1(O[Si](C)(C)C)CCCC[C@@H]1C
InChIInChI=1S/C12H26O2Si/c1-6-13-12(14-15(3,4)5)10-8-7-9-11(12)2/h11H,6-10H2,1-5H3/t11-,12-/m0/s1
InChIKeyYXAKCMOLEHDLKG-RYUDHWBXSA-N
MW230.42 g/mol
LogP3.78
Rot. Bonds4

About [(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane

[(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane (PubChem CID 101062840) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is [(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane
PubChem CID101062840
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Name[(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane
SMILESCCO[C@]1(O[Si](C)(C)C)CCCC[C@@H]1C
InChIInChI=1S/C12H26O2Si/c1-6-13-12(14-15(3,4)5)10-8-7-9-11(12)2/h11H,6-10H2,1-5H3/t11-,12-/m0/s1
InChIKeyYXAKCMOLEHDLKG-RYUDHWBXSA-N
XLogP3.78
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1,1-Diethoxy-2-methylcyclohexane
CID 12269204
Methoxy-dimethyl-(2-methylcyclohexyl)oxysilane
CID 68004391
2-(Cyclohexylmethoxy)ethyl-diethyl-methoxysilane
CID 142689216
[Cyclohexyl(ethoxy)methoxy]-ethyl-dimethoxysilane
CID 151730406
Cyclohexylmethoxy-dimethyl-(triethoxymethoxy)silane
CID 154014038
(2-Butyl-1-ethoxycyclopropyl)oxy-trimethylsilane
CID 156790014
(2,2-Diethoxy-3-ethylcyclohexyl)-methylsilane
CID 174401826
1-(Cyclohexylmethoxy)ethoxy-ethylsilane
CID 175174269
1-(Cyclohexylmethoxy)ethoxy-methylsilane
CID 175180358
(1-Ethoxy-2,2-dimethylcyclohexyl)oxy-trimethylsilane
CID 101062841
[(1S,2S)-1-ethoxy-2-ethylcyclohexyl]oxy-trimethylsilane
CID 101062842
[Cyclohexyl(methoxy)methoxy]-trimethylsilane
CID 102156176

Frequently Asked Questions

What is the IUPAC name of [(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane?
The IUPAC name of [(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane (CID 101062840) is [(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane.
What is the SMILES notation for [(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane?
The canonical SMILES for [(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane is CCO[C@]1(O[Si](C)(C)C)CCCC[C@@H]1C.
What is the InChIKey of [(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane?
The InChIKey is YXAKCMOLEHDLKG-RYUDHWBXSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-6-13-12(14-15(3,4)5)10-8-7-9-11(12)2/h11H,6-10H2,1-5H3/t11-,12-/m0/s1.
What are the key properties of [(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane?
[(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane has a molecular weight of 230.42 g/mol, XLogP of 3.78, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2S)-1-ethoxy-2-methylcyclohexyl]oxy-trimethylsilane is sourced from PubChem (CID 101062840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).