6,7-Methylenedioxyphthalide

Base Information

• Chemical Name: 6,7-Methylenedioxyphthalide
• CAS No.: 4741-65-5
• Molecular Formula: C9H6O4
• Molecular Weight: 178.14
• DSSTox Substance ID: DTXSID001288495
• Nikkaji Number: J908.762A
• Wikidata: Q105276304
• Mol file: 4741-65-5.mol

Synonyms:6,7-Methylenedioxyphthalide;Furo[3,4-e]-1,3-benzodioxol-8(6H)-one;4741-65-5;DTXSID001288495;AKOS000277820;furo[3,4-e]-1 ,3-benzodioxol-8( 6h)-one;3,5,11-trioxatricyclo[7.3.0.0?,?]dodeca-1,6,8-trien-12-one

Chemical Property of 6,7-Methylenedioxyphthalide

Chemical Property:

• PSA: 44.76000
• LogP: 1.08570
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 178.02660867
• Heavy Atom Count: 13
• Complexity: 240

Purity/Quality:

FURO[3,4-E]-1,3-BENZODIOXOL-8(6H)-ONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2=C(C3=C(C=C2)OCO3)C(=O)O1