3-trimethylsilylpropanal

C6H14OSi — CID 10986254

IUPAC3-trimethylsilylpropanal
SMILESC[Si](C)(C)CCC=O
InChIInChI=1S/C6H14OSi/c1-8(2,3)6-4-5-7/h5H,4,6H2,1-3H3
InChIKeyDLZRCTHPQQALDW-UHFFFAOYSA-N
MW130.26 g/mol
LogP1.91
Rot. Bonds3

About 3-trimethylsilylpropanal

3-trimethylsilylpropanal (PubChem CID 10986254) has the molecular formula C6H14OSi and a molecular weight of 130.26 g/mol. Its IUPAC name is 3-trimethylsilylpropanal.

Molecular Properties

Compound Name3-trimethylsilylpropanal
PubChem CID10986254
Molecular FormulaC6H14OSi
Molecular Weight130.26 g/mol
Exact Mass130.08
IUPAC Name3-trimethylsilylpropanal
SMILESC[Si](C)(C)CCC=O
InChIInChI=1S/C6H14OSi/c1-8(2,3)6-4-5-7/h5H,4,6H2,1-3H3
InChIKeyDLZRCTHPQQALDW-UHFFFAOYSA-N
XLogP1.91
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.26
LogP ≤ 51.91
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

8-trimethylsilyloctanal
CID 164916238
3-[methyl(dipropyl)silyl]propanal
CID 14492126
4-trimethylsilylbut-1-enyl formate
CID 57154095
3-[methyl-bis[[methyl-bis(trimethylsilyloxy)silyl]oxy]silyl]propanal
CID 169242948
5-oxo-N-(3-trimethylsilylpropyl)pentanamide
CID 18730827
2-trimethylsilylethyl 5-oxopentanoate
CID 11127685
trimethyl(4-methylpent-3-enyl)silane
CID 12845805
6-trimethylsilylhex-4-ynal
CID 10986668
butanal;propane
CID 142417026
alumane;butanal
CID 175259224
butanal;dihydrate
CID 144519369
butanal;hydrate;hydrofluoride
CID 174309554

Frequently Asked Questions

What is the IUPAC name of 3-trimethylsilylpropanal?
The IUPAC name of 3-trimethylsilylpropanal (CID 10986254) is 3-trimethylsilylpropanal.
What is the SMILES notation for 3-trimethylsilylpropanal?
The canonical SMILES for 3-trimethylsilylpropanal is C[Si](C)(C)CCC=O.
What is the InChIKey of 3-trimethylsilylpropanal?
The InChIKey is DLZRCTHPQQALDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14OSi/c1-8(2,3)6-4-5-7/h5H,4,6H2,1-3H3.
What are the key properties of 3-trimethylsilylpropanal?
3-trimethylsilylpropanal has a molecular weight of 130.26 g/mol, XLogP of 1.91, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-trimethylsilylpropanal is sourced from PubChem (CID 10986254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).