3-(3-silylpropoxy)propanal

C6H14O2Si — CID 174928401

IUPAC3-(3-silylpropoxy)propanal
SMILESO=CCCOCCC[SiH3]
InChIInChI=1S/C6H14O2Si/c7-3-1-4-8-5-2-6-9/h3H,1-2,4-6H2,9H3
InChIKeyDJVMCXFGCKVKIG-UHFFFAOYSA-N
MW146.26 g/mol
LogP-0.23
Rot. Bonds6

About 3-(3-silylpropoxy)propanal

3-(3-silylpropoxy)propanal (PubChem CID 174928401) has the molecular formula C6H14O2Si and a molecular weight of 146.26 g/mol. Its IUPAC name is 3-(3-silylpropoxy)propanal.

Molecular Properties

Compound Name3-(3-silylpropoxy)propanal
PubChem CID174928401
Molecular FormulaC6H14O2Si
Molecular Weight146.26 g/mol
Exact Mass146.08
IUPAC Name3-(3-silylpropoxy)propanal
SMILESO=CCCOCCC[SiH3]
InChIInChI=1S/C6H14O2Si/c7-3-1-4-8-5-2-6-9/h3H,1-2,4-6H2,9H3
InChIKeyDJVMCXFGCKVKIG-UHFFFAOYSA-N
XLogP-0.23
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.26
LogP ≤ 5-0.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(3-oxopropoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanal
CID 129055846
3-[2-(2-butoxyethoxy)ethoxy]propanal
CID 158726364
3-heptoxypropanal
CID 59708059
3-(5-sulfanylpentoxy)propanal
CID 177265933
16-(16-oxohexadecoxy)hexadecanal
CID 87509641
10-(10-oxodecoxy)decanal
CID 151900645
ethane;tris(4-[2-(4-oxobutoxy)ethoxy]butanal)
CID 158890200
3-(3-trimethoxysilylpropoxy)propanal
CID 174937943
9-silylnonanal
CID 123563301
10-silyldecanal
CID 123679175
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanal
CID 145435287
3-[2-[bis[2-(3-oxopropoxy)ethyl]amino]ethoxy]propanal
CID 139446928

Frequently Asked Questions

What is the IUPAC name of 3-(3-silylpropoxy)propanal?
The IUPAC name of 3-(3-silylpropoxy)propanal (CID 174928401) is 3-(3-silylpropoxy)propanal.
What is the SMILES notation for 3-(3-silylpropoxy)propanal?
The canonical SMILES for 3-(3-silylpropoxy)propanal is O=CCCOCCC[SiH3].
What is the InChIKey of 3-(3-silylpropoxy)propanal?
The InChIKey is DJVMCXFGCKVKIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O2Si/c7-3-1-4-8-5-2-6-9/h3H,1-2,4-6H2,9H3.
What are the key properties of 3-(3-silylpropoxy)propanal?
3-(3-silylpropoxy)propanal has a molecular weight of 146.26 g/mol, XLogP of -0.23, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-silylpropoxy)propanal is sourced from PubChem (CID 174928401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).