Home Carboxys 2-Hydroxy-1,3-oxazole-5-carboxylic acid

2-Hydroxy-1,3-oxazole-5-carboxylic acid

CAS No.:
1407858-88-1
Catalog Number:
AG00HVW5
Molecular Formula:
C4H3NO4
Molecular Weight:
129.0709
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Product Description
Catalog Number:
AG00HVW5
Chemical Name:
2-Hydroxy-1,3-oxazole-5-carboxylic acid
CAS Number:
1407858-88-1
Molecular Formula:
C4H3NO4
Molecular Weight:
129.0709
MDL Number:
MFCD28166386
IUPAC Name:
2-oxo-3H-1,3-oxazole-5-carboxylic acid
InChI:
InChI=1S/C4H3NO4/c6-3(7)2-1-5-4(8)9-2/h1H,(H,5,8)(H,6,7)
InChI Key:
JYNCBJSUVBTQPI-UHFFFAOYSA-N
SMILES:
Oc1ncc(o1)C(=O)O
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.006g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
129.071g/mol
Monoisotopic Mass:
129.006g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties