1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol

C12H24O2Si — CID 13183200

IUPAC1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol
SMILESC[Si](C)(C)/C(=C/CO)C1(O)CCCCC1
InChIInChI=1S/C12H24O2Si/c1-15(2,3)11(7-10-13)12(14)8-5-4-6-9-12/h7,13-14H,4-6,8-10H2,1-3H3/b11-7+
InChIKeySTFNFMKFCYRZJL-YRNVUSSQSA-N
MW228.41 g/mol
LogP2.48
Rot. Bonds3

About 1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol

1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol (PubChem CID 13183200) has the molecular formula C12H24O2Si and a molecular weight of 228.41 g/mol. Its IUPAC name is 1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol
PubChem CID13183200
Molecular FormulaC12H24O2Si
Molecular Weight228.41 g/mol
Exact Mass228.15
IUPAC Name1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol
SMILESC[Si](C)(C)/C(=C/CO)C1(O)CCCCC1
InChIInChI=1S/C12H24O2Si/c1-15(2,3)11(7-10-13)12(14)8-5-4-6-9-12/h7,13-14H,4-6,8-10H2,1-3H3/b11-7+
InChIKeySTFNFMKFCYRZJL-YRNVUSSQSA-N
XLogP2.48
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.41
LogP ≤ 52.48
H-Bond Donors ≤ 52
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-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol?
The IUPAC name of 1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol (CID 13183200) is 1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol?
The canonical SMILES for 1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol is C[Si](C)(C)/C(=C/CO)C1(O)CCCCC1.
What is the InChIKey of 1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol?
The InChIKey is STFNFMKFCYRZJL-YRNVUSSQSA-N. The full InChI is InChI=1S/C12H24O2Si/c1-15(2,3)11(7-10-13)12(14)8-5-4-6-9-12/h7,13-14H,4-6,8-10H2,1-3H3/b11-7+.
What are the key properties of 1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol?
1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol has a molecular weight of 228.41 g/mol, XLogP of 2.48, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol is sourced from PubChem (CID 13183200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).