2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde

C15H30O5Si — CID 552050

IUPAC2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde
SMILESCC(CC1OC(C)(C)OC1C=O)OCOCC[Si](C)(C)C
InChIInChI=1S/C15H30O5Si/c1-12(18-11-17-7-8-21(4,5)6)9-13-14(10-16)20-15(2,3)19-13/h10,12-14H,7-9,11H2,1-6H3
InChIKeyOLHMIIBDMRMZMJ-UHFFFAOYSA-N
MW318.49 g/mol
LogP2.81
Rot. Bonds9

About 2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde

2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde (PubChem CID 552050) has the molecular formula C15H30O5Si and a molecular weight of 318.49 g/mol. Its IUPAC name is 2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde.

Molecular Properties

Compound Name2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde
PubChem CID552050
Molecular FormulaC15H30O5Si
Molecular Weight318.49 g/mol
Exact Mass318.19
IUPAC Name2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde
SMILESCC(CC1OC(C)(C)OC1C=O)OCOCC[Si](C)(C)C
InChIInChI=1S/C15H30O5Si/c1-12(18-11-17-7-8-21(4,5)6)9-13-14(10-16)20-15(2,3)19-13/h10,12-14H,7-9,11H2,1-6H3
InChIKeyOLHMIIBDMRMZMJ-UHFFFAOYSA-N
XLogP2.81
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.49
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4S,5S)-5-[(4S,5S)-5-formyl-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde
CID 11311453
(2R)-2-[tert-butyl(dimethyl)silyl]oxy-2-[(4R,5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]acetaldehyde
CID 11305043
2-[2-[(2R)-2-[tert-butyl(dimethyl)silyl]oxy-3-(methoxymethoxy)propyl]-1,3-dioxolan-2-yl]acetaldehyde
CID 11348626
(2R,3S,5S)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-(methoxymethoxy)hexanal
CID 11611502
methyl (4S,5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-3-oxopropyl]-2,2-dimethyl-1,3-dioxolane-4-carboxylate
CID 102587266
(4R,5R)-5-[(4R,5R)-5-formyl-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde
CID 15432831
2,2-Dimethyl-5-(2,2,5-trimethyl-1,3-dioxolan-4-yl)-1,3-dioxolane-4-carbaldehyde
CID 13844909
2-Ethoxy-2-[5-(1-ethoxy-2-oxoethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]acetaldehyde
CID 53954237
5-[2-[Tert-butyl(dimethyl)silyl]oxyethyl]-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde
CID 58750323
(4S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-2,2-dimethyl-1,3-dioxolane-4-carbaldehyde
CID 59466677
(2S,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxyoxolane-2,5-dicarbaldehyde
CID 150066859
(3S)-4-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-(2-trimethylsilylethoxymethoxy)butanal
CID 10734348

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde?
The IUPAC name of 2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde (CID 552050) is 2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde.
What is the SMILES notation for 2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde?
The canonical SMILES for 2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde is CC(CC1OC(C)(C)OC1C=O)OCOCC[Si](C)(C)C.
What is the InChIKey of 2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde?
The InChIKey is OLHMIIBDMRMZMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O5Si/c1-12(18-11-17-7-8-21(4,5)6)9-13-14(10-16)20-15(2,3)19-13/h10,12-14H,7-9,11H2,1-6H3.
What are the key properties of 2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde?
2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde has a molecular weight of 318.49 g/mol, XLogP of 2.81, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-5-[2-(2-trimethylsilylethoxymethoxy)propyl]-1,3-dioxolane-4-carbaldehyde is sourced from PubChem (CID 552050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).