3-[dimethyl(phenyl)silyl]propanal

C11H16OSi — CID 15391460

IUPAC3-[dimethyl(phenyl)silyl]propanal
SMILESC[Si](C)(CCC=O)c1ccccc1
InChIInChI=1S/C11H16OSi/c1-13(2,10-6-9-12)11-7-4-3-5-8-11/h3-5,7-9H,6,10H2,1-2H3
InChIKeyLULMCNHAQAVYHT-UHFFFAOYSA-N
MW192.33 g/mol
LogP2.19
Rot. Bonds4

About 3-[dimethyl(phenyl)silyl]propanal

3-[dimethyl(phenyl)silyl]propanal (PubChem CID 15391460) has the molecular formula C11H16OSi and a molecular weight of 192.33 g/mol. Its IUPAC name is 3-[dimethyl(phenyl)silyl]propanal.

Molecular Properties

Compound Name3-[dimethyl(phenyl)silyl]propanal
PubChem CID15391460
Molecular FormulaC11H16OSi
Molecular Weight192.33 g/mol
Exact Mass192.10
IUPAC Name3-[dimethyl(phenyl)silyl]propanal
SMILESC[Si](C)(CCC=O)c1ccccc1
InChIInChI=1S/C11H16OSi/c1-13(2,10-6-9-12)11-7-4-3-5-8-11/h3-5,7-9H,6,10H2,1-2H3
InChIKeyLULMCNHAQAVYHT-UHFFFAOYSA-N
XLogP2.19
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.33
LogP ≤ 52.19
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

Phenyltriethoxysilane
CID 13075
Ethoxydimethylphenylsilane
CID 15770
Benzene, (diethoxymethylsilyl)-
CID 69891
Ethoxymethyldiphenylsilane
CID 74576
Diphenylvinylethoxysilane
CID 87366
Silane, methoxydimethylphenyl-
CID 140300
Propanal, 2-(phenylseleno)-
CID 356062
1-Dimethyl(phenyl)silyloxybutane
CID 606298
(3S,4E)-Methyl 3-(dimethylphenylsilyl)-4-hexenoate
CID 10038373
(3R,4E)-Methyl 3-(dimethylphenylsilyl)-4-hexenoate
CID 10515647
(1-Hydroxyethyl)dimethyl(phenyl)silane
CID 262870
1-Dimethyl(phenyl)silyloxyhexane
CID 613478

Frequently Asked Questions

What is the IUPAC name of 3-[dimethyl(phenyl)silyl]propanal?
The IUPAC name of 3-[dimethyl(phenyl)silyl]propanal (CID 15391460) is 3-[dimethyl(phenyl)silyl]propanal.
What is the SMILES notation for 3-[dimethyl(phenyl)silyl]propanal?
The canonical SMILES for 3-[dimethyl(phenyl)silyl]propanal is C[Si](C)(CCC=O)c1ccccc1.
What is the InChIKey of 3-[dimethyl(phenyl)silyl]propanal?
The InChIKey is LULMCNHAQAVYHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16OSi/c1-13(2,10-6-9-12)11-7-4-3-5-8-11/h3-5,7-9H,6,10H2,1-2H3.
What are the key properties of 3-[dimethyl(phenyl)silyl]propanal?
3-[dimethyl(phenyl)silyl]propanal has a molecular weight of 192.33 g/mol, XLogP of 2.19, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dimethyl(phenyl)silyl]propanal is sourced from PubChem (CID 15391460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).