2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid

Base Information

• Chemical Name: 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid
• CAS No.: 906728-33-4
• Molecular Formula: C5H5 N O4
• Molecular Weight: 0
• NSC Number: 156906
• DSSTox Substance ID: DTXSID30303132
• Mol file: 906728-33-4.mol

Synonyms:906728-33-4;2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid;NSC156906;4-Oxazolecarboxylicacid, 4,5-dihydro-2-methyl-5-oxo-;DTXSID30303132;NSC-156906;4-OXAZOLECARBOXYLIC ACID,4,5-DIHYDRO-2-METHYL-5-OXO-

Chemical Property of 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid

Chemical Property:

• PSA: 75.96000
• LogP: -1.14960
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 143.02185764
• Heavy Atom Count: 10
• Complexity: 220

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC(C(=O)O1)C(=O)O