2-dimethylsilyloxyhexanal

C8H18O2Si — CID 131739304

IUPAC2-dimethylsilyloxyhexanal
SMILESCCCCC(C=O)O[SiH](C)C
InChIInChI=1S/C8H18O2Si/c1-4-5-6-8(7-9)10-11(2)3/h7-8,11H,4-6H2,1-3H3
InChIKeyFUOWNMXXZNGXTK-UHFFFAOYSA-N
MW174.32 g/mol
LogP1.74
Rot. Bonds6

About 2-dimethylsilyloxyhexanal

2-dimethylsilyloxyhexanal (PubChem CID 131739304) has the molecular formula C8H18O2Si and a molecular weight of 174.32 g/mol. Its IUPAC name is 2-dimethylsilyloxyhexanal.

Molecular Properties

Compound Name2-dimethylsilyloxyhexanal
PubChem CID131739304
Molecular FormulaC8H18O2Si
Molecular Weight174.32 g/mol
Exact Mass174.11
IUPAC Name2-dimethylsilyloxyhexanal
SMILESCCCCC(C=O)O[SiH](C)C
InChIInChI=1S/C8H18O2Si/c1-4-5-6-8(7-9)10-11(2)3/h7-8,11H,4-6H2,1-3H3
InChIKeyFUOWNMXXZNGXTK-UHFFFAOYSA-N
XLogP1.74
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.32
LogP ≤ 51.74
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'}

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Frequently Asked Questions

What is the IUPAC name of 2-dimethylsilyloxyhexanal?
The IUPAC name of 2-dimethylsilyloxyhexanal (CID 131739304) is 2-dimethylsilyloxyhexanal.
What is the SMILES notation for 2-dimethylsilyloxyhexanal?
The canonical SMILES for 2-dimethylsilyloxyhexanal is CCCCC(C=O)O[SiH](C)C.
What is the InChIKey of 2-dimethylsilyloxyhexanal?
The InChIKey is FUOWNMXXZNGXTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O2Si/c1-4-5-6-8(7-9)10-11(2)3/h7-8,11H,4-6H2,1-3H3.
What are the key properties of 2-dimethylsilyloxyhexanal?
2-dimethylsilyloxyhexanal has a molecular weight of 174.32 g/mol, XLogP of 1.74, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dimethylsilyloxyhexanal is sourced from PubChem (CID 131739304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).