1,3-Benzodioxole-5-carboxylic acid, 6-iodo-, methyl ester

Base Information

• Chemical Name: 1,3-Benzodioxole-5-carboxylic acid, 6-iodo-, methyl ester
• CAS No.: 61599-80-2
• Molecular Formula: C9H7IO4
• Molecular Weight: 306.057
• DSSTox Substance ID: DTXSID40455959
• Nikkaji Number: J1.136.534E
• Wikidata: Q82278137
• Mol file: 61599-80-2.mol

Synonyms:61599-80-2;1,3-Benzodioxole-5-carboxylic acid, 6-iodo-, methyl ester;DTXSID40455959;6-Iodo-1,3-benzodioxole-5-carboxylic acid methyl ester

Chemical Property of 1,3-Benzodioxole-5-carboxylic acid, 6-iodo-, methyl ester

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 305.93891
• Heavy Atom Count: 14
• Complexity: 233

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=CC2=C(C=C1I)OCO2