2-Pentenedioic acid, 3-chloro-, dimethyl ester, (E)-

Base Information

• Chemical Name: 2-Pentenedioic acid, 3-chloro-, dimethyl ester, (E)-
• CAS No.: 66016-87-3
• Molecular Formula: C7H9ClO4
• DSSTox Substance ID: DTXSID40400363

Synonyms:66016-88-4;1,5-DIMETHYL 3-CHLOROPENT-2-ENEDIOATE;2-Pentenedioic acid, 3-chloro-, dimethyl ester, (E)-;66016-87-3;dimethyl 3-chloroglutaconate;SCHEMBL8992417;DTXSID40400363;8-CHLORO-6-HYDROXYMETHYLCAPRYLATE

Chemical Property of 2-Pentenedioic acid, 3-chloro-, dimethyl ester, (E)-

Chemical Property:

• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 192.0189365
• Heavy Atom Count: 12
• Complexity: 210

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CC(=CC(=O)OC)Cl

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