3-[methyl(dipropyl)silyl]propanal

C10H22OSi — CID 14492126

IUPAC3-[methyl(dipropyl)silyl]propanal
SMILESCCC[Si](C)(CCC)CCC=O
InChIInChI=1S/C10H22OSi/c1-4-8-12(3,9-5-2)10-6-7-11/h7H,4-6,8-10H2,1-3H3
InChIKeyKDWGXAHXQORLFS-UHFFFAOYSA-N
MW186.37 g/mol
LogP3.47
Rot. Bonds7

About 3-[methyl(dipropyl)silyl]propanal

3-[methyl(dipropyl)silyl]propanal (PubChem CID 14492126) has the molecular formula C10H22OSi and a molecular weight of 186.37 g/mol. Its IUPAC name is 3-[methyl(dipropyl)silyl]propanal.

Molecular Properties

Compound Name3-[methyl(dipropyl)silyl]propanal
PubChem CID14492126
Molecular FormulaC10H22OSi
Molecular Weight186.37 g/mol
Exact Mass186.14
IUPAC Name3-[methyl(dipropyl)silyl]propanal
SMILESCCC[Si](C)(CCC)CCC=O
InChIInChI=1S/C10H22OSi/c1-4-8-12(3,9-5-2)10-6-7-11/h7H,4-6,8-10H2,1-3H3
InChIKeyKDWGXAHXQORLFS-UHFFFAOYSA-N
XLogP3.47
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.37
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-trimethylsilylpropanal
CID 10986254
butanal;propane
CID 142417026
alumane;butanal
CID 175259224
butanal;dihydrate
CID 144519369
lithium;butanal;hydride
CID 172997577
butanal;hydrate;hydrofluoride
CID 174309554
magnesium;butanal;hydride
CID 173011823
butanal;pentanedial
CID 87991120
butanal;carbon dioxide
CID 91446908
neodymium;pentanal
CID 87838749
pentanal;stannane
CID 173131916
butanal;propanal;propane
CID 88619046

Frequently Asked Questions

What is the IUPAC name of 3-[methyl(dipropyl)silyl]propanal?
The IUPAC name of 3-[methyl(dipropyl)silyl]propanal (CID 14492126) is 3-[methyl(dipropyl)silyl]propanal.
What is the SMILES notation for 3-[methyl(dipropyl)silyl]propanal?
The canonical SMILES for 3-[methyl(dipropyl)silyl]propanal is CCC[Si](C)(CCC)CCC=O.
What is the InChIKey of 3-[methyl(dipropyl)silyl]propanal?
The InChIKey is KDWGXAHXQORLFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22OSi/c1-4-8-12(3,9-5-2)10-6-7-11/h7H,4-6,8-10H2,1-3H3.
What are the key properties of 3-[methyl(dipropyl)silyl]propanal?
3-[methyl(dipropyl)silyl]propanal has a molecular weight of 186.37 g/mol, XLogP of 3.47, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl(dipropyl)silyl]propanal is sourced from PubChem (CID 14492126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).