1-cyclohexyl-2-methoxy-2-trimethylsilylethanol

C12H26O2Si — CID 12552144

IUPAC1-cyclohexyl-2-methoxy-2-trimethylsilylethanol
SMILESCOC(C(O)C1CCCCC1)[Si](C)(C)C
InChIInChI=1S/C12H26O2Si/c1-14-12(15(2,3)4)11(13)10-8-6-5-7-9-10/h10-13H,5-9H2,1-4H3
InChIKeyDKZINKFBKQKZFV-UHFFFAOYSA-N
MW230.42 g/mol
LogP2.82
Rot. Bonds4

About 1-cyclohexyl-2-methoxy-2-trimethylsilylethanol

1-cyclohexyl-2-methoxy-2-trimethylsilylethanol (PubChem CID 12552144) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is 1-cyclohexyl-2-methoxy-2-trimethylsilylethanol.

Molecular Properties

Compound Name1-cyclohexyl-2-methoxy-2-trimethylsilylethanol
PubChem CID12552144
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Name1-cyclohexyl-2-methoxy-2-trimethylsilylethanol
SMILESCOC(C(O)C1CCCCC1)[Si](C)(C)C
InChIInChI=1S/C12H26O2Si/c1-14-12(15(2,3)4)11(13)10-8-6-5-7-9-10/h10-13H,5-9H2,1-4H3
InChIKeyDKZINKFBKQKZFV-UHFFFAOYSA-N
XLogP2.82
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-methoxy-2-trimethylsilylethanol?
The IUPAC name of 1-cyclohexyl-2-methoxy-2-trimethylsilylethanol (CID 12552144) is 1-cyclohexyl-2-methoxy-2-trimethylsilylethanol.
What is the SMILES notation for 1-cyclohexyl-2-methoxy-2-trimethylsilylethanol?
The canonical SMILES for 1-cyclohexyl-2-methoxy-2-trimethylsilylethanol is COC(C(O)C1CCCCC1)[Si](C)(C)C.
What is the InChIKey of 1-cyclohexyl-2-methoxy-2-trimethylsilylethanol?
The InChIKey is DKZINKFBKQKZFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-14-12(15(2,3)4)11(13)10-8-6-5-7-9-10/h10-13H,5-9H2,1-4H3.
What are the key properties of 1-cyclohexyl-2-methoxy-2-trimethylsilylethanol?
1-cyclohexyl-2-methoxy-2-trimethylsilylethanol has a molecular weight of 230.42 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-methoxy-2-trimethylsilylethanol is sourced from PubChem (CID 12552144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).