Home Carboxys 3-Methyl-4-isoxazolecarboxylic acid

3-Methyl-4-isoxazolecarboxylic acid

CAS No.:
17153-20-7
Catalog Number:
AG0033RD
Molecular Formula:
C5H5NO3
Molecular Weight:
127.0981
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$69
- +
5g
≥98%
In Stock USA
United States
$191
- +
10g
98%
In Stock USA
United States
$344
- +
25g
98%
In Stock USA
United States
$688
- +
100g
98%
In Stock USA
United States
$1919
- +
Product Description
Catalog Number:
AG0033RD
Chemical Name:
3-Methyl-4-isoxazolecarboxylic acid
CAS Number:
17153-20-7
Molecular Formula:
C5H5NO3
Molecular Weight:
127.0981
MDL Number:
MFCD01318161
IUPAC Name:
3-methyl-1,2-oxazole-4-carboxylic acid
InChI:
InChI=1S/C5H5NO3/c1-3-4(5(7)8)2-9-6-3/h2H,1H3,(H,7,8)
InChI Key:
YBLSBWHFPXDRHC-UHFFFAOYSA-N
SMILES:
Cc1nocc1C(=O)O
Properties
Complexity:
125  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.027g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
127.099g/mol
Monoisotopic Mass:
127.027g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Literature
Title Journal
Spectrophotometric stability-indicating methods for the determination of leflunomide in the presence of its degradates. Journal of AOAC International 20060101
Properties