(3R)-3-triethylsilyloxyhexanal

C12H26O2Si — CID 53328467

IUPAC(3R)-3-triethylsilyloxyhexanal
SMILESCCC[C@H](CC=O)O[Si](CC)(CC)CC
InChIInChI=1S/C12H26O2Si/c1-5-9-12(10-11-13)14-15(6-2,7-3)8-4/h11-12H,5-10H2,1-4H3/t12-/m1/s1
InChIKeyWTEUTSHWBFNIAB-GFCCVEGCSA-N
MW230.42 g/mol
LogP3.77
Rot. Bonds9

About (3R)-3-triethylsilyloxyhexanal

(3R)-3-triethylsilyloxyhexanal (PubChem CID 53328467) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is (3R)-3-triethylsilyloxyhexanal.

Molecular Properties

Compound Name(3R)-3-triethylsilyloxyhexanal
PubChem CID53328467
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Name(3R)-3-triethylsilyloxyhexanal
SMILESCCC[C@H](CC=O)O[Si](CC)(CC)CC
InChIInChI=1S/C12H26O2Si/c1-5-9-12(10-11-13)14-15(6-2,7-3)8-4/h11-12H,5-10H2,1-4H3/t12-/m1/s1
InChIKeyWTEUTSHWBFNIAB-GFCCVEGCSA-N
XLogP3.77
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (3R)-3-triethylsilyloxyhexanal with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3R)-3-triethylsilyloxyhexanal?
The IUPAC name of (3R)-3-triethylsilyloxyhexanal (CID 53328467) is (3R)-3-triethylsilyloxyhexanal.
What is the SMILES notation for (3R)-3-triethylsilyloxyhexanal?
The canonical SMILES for (3R)-3-triethylsilyloxyhexanal is CCC[C@H](CC=O)O[Si](CC)(CC)CC.
What is the InChIKey of (3R)-3-triethylsilyloxyhexanal?
The InChIKey is WTEUTSHWBFNIAB-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-5-9-12(10-11-13)14-15(6-2,7-3)8-4/h11-12H,5-10H2,1-4H3/t12-/m1/s1.
What are the key properties of (3R)-3-triethylsilyloxyhexanal?
(3R)-3-triethylsilyloxyhexanal has a molecular weight of 230.42 g/mol, XLogP of 3.77, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-triethylsilyloxyhexanal is sourced from PubChem (CID 53328467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).