Ethyl isoxazolo[5,4-c]isoxazole-3-carboxylate

Base Information

• Chemical Name: Ethyl isoxazolo[5,4-c]isoxazole-3-carboxylate
• CAS No.: 183666-51-5
• Molecular Formula: C7H6 N2 O4
• Molecular Weight: 182.13354
• DSSTox Substance ID: DTXSID50445664
• Nikkaji Number: J773.133G
• Wikidata: Q82264171
• Mol file: 183666-51-5.mol

Synonyms:183666-51-5;ethyl isoxazolo[5,4-c]isoxazole-3-carboxylate;ethyl [1,2]oxazolo[4,3-d][1,2]oxazole-3-carboxylate;Isoxazolo[5,4-c]isoxazole-3-carboxylic acid, ethyl ester (9CI);AGN-PC-0NBJ6E;DTXSID50445664;ISOXAZOLO[5,4-C]ISOXAZOLE-3-CARBOXYLIC ACID ETHYL ESTER

Chemical Property of Ethyl isoxazolo[5,4-c]isoxazole-3-carboxylate

Chemical Property:

• PSA: 78.36000
• LogP: 0.99250
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 182.03275668
• Heavy Atom Count: 13
• Complexity: 211

Purity/Quality:

ISOXAZOLO[5,4-C]ISOXAZOLE-3-CARBOXYLIC ACID, ETHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=NOC2=NOC=C12