2-cyclohexylidene-3-trimethylsilylpropan-1-ol

C12H24OSi — CID 12062907

IUPAC2-cyclohexylidene-3-trimethylsilylpropan-1-ol
SMILESC[Si](C)(C)CC(CO)=C1CCCCC1
InChIInChI=1S/C12H24OSi/c1-14(2,3)10-12(9-13)11-7-5-4-6-8-11/h13H,4-10H2,1-3H3
InChIKeyBSAGCOSCIXHZKG-UHFFFAOYSA-N
MW212.41 g/mol
LogP3.58
Rot. Bonds3

About 2-cyclohexylidene-3-trimethylsilylpropan-1-ol

2-cyclohexylidene-3-trimethylsilylpropan-1-ol (PubChem CID 12062907) has the molecular formula C12H24OSi and a molecular weight of 212.41 g/mol. Its IUPAC name is 2-cyclohexylidene-3-trimethylsilylpropan-1-ol.

Molecular Properties

Compound Name2-cyclohexylidene-3-trimethylsilylpropan-1-ol
PubChem CID12062907
Molecular FormulaC12H24OSi
Molecular Weight212.41 g/mol
Exact Mass212.16
IUPAC Name2-cyclohexylidene-3-trimethylsilylpropan-1-ol
SMILESC[Si](C)(C)CC(CO)=C1CCCCC1
InChIInChI=1S/C12H24OSi/c1-14(2,3)10-12(9-13)11-7-5-4-6-8-11/h13H,4-10H2,1-3H3
InChIKeyBSAGCOSCIXHZKG-UHFFFAOYSA-N
XLogP3.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.41
LogP ≤ 53.58
H-Bond Donors ≤ 51
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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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylidene-3-trimethylsilylpropan-1-ol?
The IUPAC name of 2-cyclohexylidene-3-trimethylsilylpropan-1-ol (CID 12062907) is 2-cyclohexylidene-3-trimethylsilylpropan-1-ol.
What is the SMILES notation for 2-cyclohexylidene-3-trimethylsilylpropan-1-ol?
The canonical SMILES for 2-cyclohexylidene-3-trimethylsilylpropan-1-ol is C[Si](C)(C)CC(CO)=C1CCCCC1.
What is the InChIKey of 2-cyclohexylidene-3-trimethylsilylpropan-1-ol?
The InChIKey is BSAGCOSCIXHZKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24OSi/c1-14(2,3)10-12(9-13)11-7-5-4-6-8-11/h13H,4-10H2,1-3H3.
What are the key properties of 2-cyclohexylidene-3-trimethylsilylpropan-1-ol?
2-cyclohexylidene-3-trimethylsilylpropan-1-ol has a molecular weight of 212.41 g/mol, XLogP of 3.58, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylidene-3-trimethylsilylpropan-1-ol is sourced from PubChem (CID 12062907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).