Tert-butyl 4-bromobutanoate

Base Information

• Chemical Name: Tert-butyl 4-bromobutanoate
• CAS No.: 110611-91-1
• Molecular Formula: C71H110NO15P
• Molecular Weight: 223.11
• Hs Code.: 2932999099
• European Community (EC) Number: 600-981-0,692-867-2
• DSSTox Substance ID: DTXSID30911796
• Nikkaji Number: J2.668.993G
• Wikidata: Q72502475
• Mol file: 110611-91-1.mol

Synonyms:tert-butyl 4-bromobutanoate;110661-91-1;110611-91-1;t-Butyl 4-bromobutyrate;tert-butyl 4-bromobutyrate;t-butyl 4-bromobutanoate;4-Bromo-butyric acid tert-butyl ester;t-butyl-4-bromobutyrate;MFCD02179416;Butanoic acid, 4-bromo-, 1,1-dimethylethyl ester;4-bromobutyric acid t-butyl ester;tert-butyl4-bromobutanoate;t-Butyl4-bromobutyrate;4-bromobutyric acid-t-butyl ester;tert-Butyl-4-bromobutyrate;tert.-butyl 4-bromobutanoate;SCHEMBL130424;DTXSID30911796;HJEZRYIJNHAIGY-UHFFFAOYSA-N;4-bromobutyric acid tert-butyl ester;4-bromobutanoic acid tert-butyl ester;4-bromobutyric acid tert.-butyl ester;AKOS007930522;CS-W008626;AS-19764;SY024839;B6167;FT-0602146;FT-0706083;B57460;EN300-155386;A894866;J-524690

Chemical Property of Tert-butyl 4-bromobutanoate

Chemical Property:

• Vapor Pressure: 0.0843mmHg at 25°C
• Refractive Index: 1.46
• Boiling Point: 225.896 °C at 760 mmHg
• PKA: 4.39±0.17(Predicted)
• Flash Point: 117.145 °C
• PSA: 26.30000
• Density: 1.258 g/cm³
• LogP: 2.50320
• Storage Temp.: Refrigerator, under inert atmosphere
• Solubility.: Chloroform, Hexane
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 222.02554
• Heavy Atom Count: 11
• Complexity: 127

Purity/Quality:

99% ^*data from raw suppliers

4-(((2R,3S,4R,5R,6R)-6-(Benzyloxy)-3-((diphenoxyphosphoryl)oxy)-4-(tetradecanoyloxy)-5-((S)-3-(tetradecanoyloxy)tetradecanamido)tetrahydro-2H-pyran-2-yl)methoxy)-4-oxobutanoicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)CCCBr