Home Carboxys 3-(4-Methoxyphenyl)-5-isoxazolecarboxylic acid

3-(4-Methoxyphenyl)-5-isoxazolecarboxylic acid

CAS No.:
618383-47-4
Catalog Number:
AG003I4W
Molecular Formula:
C11H9NO4
Molecular Weight:
219.1935
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$63
- +
5g
96%
In Stock USA
United States
$188
- +
10g
96%
In Stock USA
United States
$319
- +
25g
96%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG003I4W
Chemical Name:
3-(4-Methoxyphenyl)-5-isoxazolecarboxylic acid
CAS Number:
618383-47-4
Molecular Formula:
C11H9NO4
Molecular Weight:
219.1935
MDL Number:
MFCD04124288
IUPAC Name:
3-(4-methoxyphenyl)-1,2-oxazole-5-carboxylic acid
InChI:
InChI=1S/C11H9NO4/c1-15-8-4-2-7(3-5-8)9-6-10(11(13)14)16-12-9/h2-6H,1H3,(H,13,14)
InChI Key:
WEFMAZCRNQZFAY-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1noc(c1)C(=O)O
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.053g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.196g/mol
Monoisotopic Mass:
219.053g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties