Home Carboxys 3-(1,3-Dimethyl-1h-pyrazol-4-yl)-5-methylisoxazole-4-carboxylic acid

3-(1,3-Dimethyl-1h-pyrazol-4-yl)-5-methylisoxazole-4-carboxylic acid

CAS No.:
1171972-67-0
Catalog Number:
AG0090KL
Molecular Formula:
C10H11N3O3
Molecular Weight:
221.2126
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$358
- +
5g
95%
In Stock USA
United States
$1136
- +
Product Description
Catalog Number:
AG0090KL
Chemical Name:
3-(1,3-Dimethyl-1h-pyrazol-4-yl)-5-methylisoxazole-4-carboxylic acid
CAS Number:
1171972-67-0
Molecular Formula:
C10H11N3O3
Molecular Weight:
221.2126
MDL Number:
MFCD12027175
IUPAC Name:
3-(1,3-dimethylpyrazol-4-yl)-5-methyl-1,2-oxazole-4-carboxylic acid
InChI:
InChI=1S/C10H11N3O3/c1-5-7(4-13(3)11-5)9-8(10(14)15)6(2)16-12-9/h4H,1-3H3,(H,14,15)
InChI Key:
UHDVDKQSBPUIIS-UHFFFAOYSA-N
SMILES:
Cn1nc(c(c1)c1noc(c1C(=O)O)C)C
Properties
Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.08g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.216g/mol
Monoisotopic Mass:
221.08g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
81.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties