Butyric acid, 2-ethyl-, 2,2,2-trichloroethyl ester

Base Information

• Chemical Name: Butyric acid, 2-ethyl-, 2,2,2-trichloroethyl ester
• CAS No.: 4189-10-0
• Molecular Formula: C8H13Cl3O2
• Molecular Weight: 0
• Hs Code.: 2915900090
• DSSTox Substance ID: DTXSID70194662
• Nikkaji Number: J42.961I
• Wikidata: Q83067456
• Mol file: 4189-10-0.mol

Synonyms:Trichloroethyl 2-ethylbutyrate;2-Ethylbutyric acid, ester with trichloroethanol;4189-10-0;BRN 2087075;BUTYRIC ACID, 2-ETHYL-, 2,2,2-TRICHLOROETHYL ESTER;C8H13Cl3O2;C8-H13-Cl3-O2;DTXSID70194662;LS-48030;2-Ethylbutanoic acid 2,2,2-trichloroethyl ester

Chemical Property of Butyric acid, 2-ethyl-, 2,2,2-trichloroethyl ester

Chemical Property:

• Vapor Pressure: 0.00134mmHg at 25°C
• Boiling Point: 297.5°C at 760 mmHg
• Flash Point: 116.9°C
• PSA: 26.30000
• Density: 1.246g/cm³
• LogP: 3.33600
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 245.998113
• Heavy Atom Count: 13
• Complexity: 161

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(CC)C(=O)OCC(Cl)(Cl)Cl

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