Home Carboxys 3-(hydroxymethyl)-5-methyl-1,2-oxazole-4-carboxylic acid

3-(hydroxymethyl)-5-methyl-1,2-oxazole-4-carboxylic acid

CAS No.:
1779855-86-5
Catalog Number:
AG01BBY4
Molecular Formula:
C6H7NO4
Molecular Weight:
157.1241
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Product Description
Catalog Number:
AG01BBY4
Chemical Name:
3-(hydroxymethyl)-5-methyl-1,2-oxazole-4-carboxylic acid
CAS Number:
1779855-86-5
Molecular Formula:
C6H7NO4
Molecular Weight:
157.1241
MDL Number:
MFCD28515958
IUPAC Name:
3-(hydroxymethyl)-5-methyl-1,2-oxazole-4-carboxylic acid
InChI:
InChI=1S/C6H7NO4/c1-3-5(6(9)10)4(2-8)7-11-3/h8H,2H2,1H3,(H,9,10)
InChI Key:
FYNGPPMFXYGRNW-UHFFFAOYSA-N
SMILES:
OCc1noc(c1C(=O)O)C
Properties
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.038g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
157.125g/mol
Monoisotopic Mass:
157.038g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties