2-Heptynoic acid, 7-oxo-, methyl ester

Base Information

• Chemical Name: 2-Heptynoic acid, 7-oxo-, methyl ester
• CAS No.: 135284-85-4
• Molecular Formula: C8H10O3
• Molecular Weight: 154.166
• DSSTox Substance ID: DTXSID90453748
• Nikkaji Number: J416.810K
• Wikidata: Q82274972
• Mol file: 135284-85-4.mol

Synonyms:2-Heptynoic acid, 7-oxo-, methyl ester;135284-85-4;DTXSID90453748;7-Oxo-2-heptynoic acid methyl ester

Chemical Property of 2-Heptynoic acid, 7-oxo-, methyl ester

Chemical Property:

• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 154.062994177
• Heavy Atom Count: 11
• Complexity: 194

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C#CCCCC=O

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