Home Carboxys 5-(5-methylfuran-2-yl)-1,2-oxazole-4-carboxylic acid

5-(5-methylfuran-2-yl)-1,2-oxazole-4-carboxylic acid

CAS No.:
1469045-05-3
Catalog Number:
AG01AFCQ
Molecular Formula:
C9H7NO4
Molecular Weight:
193.1562
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Product Description
Catalog Number:
AG01AFCQ
Chemical Name:
5-(5-methylfuran-2-yl)-1,2-oxazole-4-carboxylic acid
CAS Number:
1469045-05-3
Molecular Formula:
C9H7NO4
Molecular Weight:
193.1562
MDL Number:
MFCD24170067
IUPAC Name:
5-(5-methylfuran-2-yl)-1,2-oxazole-4-carboxylic acid
InChI:
InChI=1S/C9H7NO4/c1-5-2-3-7(13-5)8-6(9(11)12)4-10-14-8/h2-4H,1H3,(H,11,12)
InChI Key:
ODJQTSUIKPLRDH-UHFFFAOYSA-N
SMILES:
Cc1ccc(o1)c1oncc1C(=O)O
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.038g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.158g/mol
Monoisotopic Mass:
193.038g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties