alpha-Methylene-1,3-benzodioxole-5-propionaldehyde

Base Information

• Chemical Name: alpha-Methylene-1,3-benzodioxole-5-propionaldehyde
• CAS No.: 54546-95-1
• Molecular Formula: C11H10 O3
• Molecular Weight: 190.1953
• European Community (EC) Number: 259-212-9
• UNII: 4GF3UP9T8V
• DSSTox Substance ID: DTXSID20202968
• Nikkaji Number: J266.911K
• Wikidata: Q83076330
• Mol file: 54546-95-1.mol

Synonyms:54546-95-1;alpha-Methylene-1,3-benzodioxole-5-propionaldehyde;EINECS 259-212-9;alpha-Methylene-1,3-benzodioxole-5-propanal;4GF3UP9T8V;DTXSID20202968;1,3-Benzodioxole-5-propanal, alpha-methylene-

Chemical Property of alpha-Methylene-1,3-benzodioxole-5-propionaldehyde

Chemical Property:

• Boiling Point: 334.2oC at 760 mmHg
• Flash Point: 147oC
• PSA: 35.53000
• Density: 1.198g/cm3
• LogP: 1.71290
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 190.062994177
• Heavy Atom Count: 14
• Complexity: 237

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=C(CC1=CC2=C(C=C1)OCO2)C=O