1,5(3H,6H)-Isobenzofurandione, 7,7a-dihydro-3-hydroxy-4,7a-dimethyl-

Base Information

• Chemical Name: 1,5(3H,6H)-Isobenzofurandione, 7,7a-dihydro-3-hydroxy-4,7a-dimethyl-
• CAS No.: 69841-90-3
• Molecular Formula: C₁₀H₁₂O₄
• Molecular Weight: 196.203
• DSSTox Substance ID: DTXSID70448036
• Mol file: 69841-90-3.mol

Synonyms:69841-90-3;1,5(3H,6H)-Isobenzofurandione, 7,7a-dihydro-3-hydroxy-4,7a-dimethyl-;DTXSID70448036

Chemical Property of 1,5(3H,6H)-Isobenzofurandione, 7,7a-dihydro-3-hydroxy-4,7a-dimethyl-

Chemical Property:

• XLogP3: -0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 196.07355886
• Heavy Atom Count: 14
• Complexity: 355

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: CC1=C2C(OC(=O)C2(CCC1=O)C)O