2-Pentenoic acid, 2-cyano-3,4-dimethyl-, ethyl ester

Base Information

• Chemical Name: 2-Pentenoic acid, 2-cyano-3,4-dimethyl-, ethyl ester
• CAS No.: 868-00-8
• Molecular Formula: C10H15NO2
• Molecular Weight: 181.235
• DSSTox Substance ID: DTXSID10407768
• Mol file: 868-00-8.mol

Synonyms:868-00-8;2-Pentenoic acid, 2-cyano-3,4-dimethyl-, ethyl ester;DTXSID10407768;AKOS024332377;2-CYANO-3,4-DIMETHYL-PENT-2-ENOIC ACID ETHYL ESTER

Chemical Property of 2-Pentenoic acid, 2-cyano-3,4-dimethyl-, ethyl ester

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 181.110278721
• Heavy Atom Count: 13
• Complexity: 268

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(=C(C)C(C)C)C#N