3-[(Tert-butyldimethylsilyl)oxy]-1-propanal

Base Information

• Chemical Name: 3-[(Tert-butyldimethylsilyl)oxy]-1-propanal
• CAS No.: 89922-82-7
• Molecular Formula: C9H20 O2 Si
• Molecular Weight: 188.342
• European Community (EC) Number: 804-611-0
• DSSTox Substance ID: DTXSID40394793
• Nikkaji Number: J755.698E
• Wikidata: Q82194414
• Mol file: 89922-82-7.mol

Synonyms:89922-82-7;3-[(TERT-BUTYLDIMETHYLSILYL)OXY]-1-PROPANAL;3-[tert-butyl(dimethyl)silyl]oxypropanal;3-(tert-butyldimethylsilyloxy)propanal;3-[(tert-Butyldimethylsilyl)oxy]propanal;3-(tert-Butyldimethylsiloxy)propanal;MFCD04039464;3-(tert-Butyldimethylsiloxy)propionaldehyde;3-((tert-butyldimethylsilyl)oxy)propanal;Propanal,3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-;3-(t-butyl-dimethyl-silanyloxy)-propionaldehyde;3-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]propanal;SCHEMBL573170;Propanal, 3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-;3-t-butyldimethylsilyloxypropanal;DTXSID40394793;3-t-butyldimethylsilyloxy propanal;WGWCJTNWUFFGFH-UHFFFAOYSA-N;3-(t-Butyldimethylsilyloxy)propanal;3-tert-butyldimethylsilyloxypropanal;BCP32384;CS-B1696;3-(t-butyldimethylsilyloxy) propanal;BBL103067;STL556876;3-(Tert-Butyldimethylsiloxy) Propanal;AKOS006292915;AM85955;3-[(t-Butyldimethylsilyl)oxy]-propanal;3-tert-butyldimethylsilyloxypropionaldehyde;AS-30268;SY043379;3-{[tert-butyl(dimethyl)silyl]oxy}propanal;3-(tert-butyldimethylsilanyloxy)propan-1-one;3-(tert-butyldimethylsilyloxy)propionaldehyde;FT-0664094;3-(tert-butyldimethylsilyloxy)-propionaldehyde;3-(tertbutyldimethylsilanyloxy)propionaldehyde;3-(tert-butyldimethylsilanyloxy)propionaldehyde;EN300-266302;3-(tertbutyl-dimethyl-silanyloxy)-propionaldehyde;3-(tert-butyl-dimethyl-silanyloxy)-propionaldehyde;A860983;3-{[(1,1-dimethylethyl)(dimethyl)silyl]oxy}propanal

Chemical Property of 3-[(Tert-butyldimethylsilyl)oxy]-1-propanal

Chemical Property:

• Vapor Pressure: 0.428mmHg at 25°C
• Refractive Index: 1.416
• Boiling Point: 195°C at 760 mmHg
• Flash Point: 59.8°C
• PSA: 26.30000
• Density: 0.892 g/mL at 25 °C
• LogP: 2.59720
• Storage Temp.: -20°C Freezer, Under Inert Atmosphere
• Solubility.: Chloroform (Slightly), Methanol (Slightly)
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 188.123256411
• Heavy Atom Count: 12
• Complexity: 147

Purity/Quality:

97% ^*data from raw suppliers

3-[(tert-Butyldimethylsilyl)oxy]-1-propanal ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)[Si](C)(C)OCCC=O
• Uses: 3-[(tert-Butyldimethylsilyl)oxy]-1-propanal is useful for preparing EGFR inhibitors for the treatment of cancer.

Technology Process of 3-[(Tert-butyldimethylsilyl)oxy]-1-propanal

There total 22 articles about 3-[(Tert-butyldimethylsilyl)oxy]-1-propanal which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%

3-tert-butyldimethylsilyloxy-1-propanol (73842-99-6) → 3-(tert-butyldimethylsilanyloxy)propionaldehyde (89922-82-7)

Guidance literature:

With thionyl chloride; dimethyl sulfoxide; triethylamine; In dichloromethane; at -78 - 20 ℃;

DOI:10.1021/ja0377596

Reference yield: 94.0%

tert-butyldimethylsilyl chloride (18162-48-6) + trimethyleneglycol (504-63-2) → 3-(tert-butyldimethylsilanyloxy)propionaldehyde (89922-82-7)

Guidance literature:

tert-butyldimethylsilyl chloride; trimethyleneglycol; With sodium hydride; In diethyl ether; at 0 - 23 ℃;

With sulfur trioxide pyridine complex; triethylamine; In dichloromethane; dimethyl sulfoxide; at 0 - 23 ℃;

DOI:10.1021/jacs.1c02150

Reference yield: 93.0%

4-[(tert-butyldimethylsilyl)oxy]-1-butene (108794-10-1) → 3-(tert-butyldimethylsilanyloxy)propionaldehyde (89922-82-7)

Guidance literature:

4-[(tert-butyldimethylsilyl)oxy]-1-butene; With ozone; In dichloromethane; at -78 ℃; for 0.166667h;

With PS-triphenylphosphine; In dichloromethane; at 20 ℃; for 14h;

DOI:10.1002/chem.200305669

upstream raw materials:

3-tert-butyldimethylsilyloxy-1-propanol

4-[(tert-butyldimethylsilyl)oxy]-1-butene

tert-butyldimethylsilyl chloride

3-Hydroxypropionitrile

Downstream raw materials:

ethyl (E)-5-((tert-butyldimethylsilyl)oxy)pent-2-enoate

(2S,3S)-5-(tert-Butyl-dimethyl-silanyloxy)-3-hydroxy-2-((S)-2-phenyl-4,5-dihydro-oxazol-4-yl)-pentanethioic acid S-tert-butyl ester

(2S,3R)-3-<3-Hydroxy-2-methoxy-5-<(tert-butyldimethylsilyl)oxy>pentanoyl>-4-(phenylmethyl)-2-oxazolidinone

(Z)-N-(3-dimethyl-t-butylsilyloxypropylidene)benzylamine N-oxide