Propanedioic acid, 2,3-butadienyl-, dimethyl ester

Base Information

• Chemical Name: Propanedioic acid, 2,3-butadienyl-, dimethyl ester
• CAS No.: 100747-44-2
• Molecular Formula: C9H12O4
• Molecular Weight: 184.192
• DSSTox Substance ID: DTXSID90466095
• Nikkaji Number: J1.099.247H
• Mol file: 100747-44-2.mol

Synonyms:100747-44-2;Propanedioic acid, 2,3-butadienyl-, dimethyl ester;DTXSID90466095;dimethyl 2-(2,3-butadienyl)malonate;2-buta-2,3-dienyl-propanedioic acid dimethyl ester

Chemical Property of Propanedioic acid, 2,3-butadienyl-, dimethyl ester

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 184.07355886
• Heavy Atom Count: 13
• Complexity: 222

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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