Ethyl 3,3,4-trimethylpentanoate

Base Information

• Chemical Name: Ethyl 3,3,4-trimethylpentanoate
• CAS No.: 80246-74-8
• Molecular Formula: C10H20O2
• DSSTox Substance ID: DTXSID60434089
• Nikkaji Number: J1.877.167E
• Wikidata: Q27159523
• Mol file: 80246-74-8.mol

Synonyms:Ethyl 3,3,4-trimethylpentanoate;80246-74-8;3,3,4-trimethyl-pentanoic acid ethyl ester;SCHEMBL2152161;CHEBI:87320;DTXSID60434089;SVZSYBFQSHHBQJ-UHFFFAOYSA-N;ethyl 3,3,4-trimethyl pentanoate;3,3,4-Trimethylpentanoic acid ethyl ester;Q27159523

Chemical Property of Ethyl 3,3,4-trimethylpentanoate

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 172.146329876
• Heavy Atom Count: 12
• Complexity: 148

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CC(C)(C)C(C)C