Home Carboxys 5-(4-Chlorophenyl)isoxazole-3-carboxylic acid

5-(4-Chlorophenyl)isoxazole-3-carboxylic acid

CAS No.:
33282-22-3
Catalog Number:
AG003M5P
Molecular Formula:
C10H6ClNO3
Molecular Weight:
223.6125
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$57
- +
5g
98%
In Stock USA
United States
$225
- +
25g
98%
In Stock USA
United States
$950
- +
Product Description
Catalog Number:
AG003M5P
Chemical Name:
5-(4-Chlorophenyl)isoxazole-3-carboxylic acid
CAS Number:
33282-22-3
Molecular Formula:
C10H6ClNO3
Molecular Weight:
223.6125
MDL Number:
MFCD06010034
IUPAC Name:
5-(4-chlorophenyl)-1,2-oxazole-3-carboxylic acid
InChI:
InChI=1S/C10H6ClNO3/c11-7-3-1-6(2-4-7)9-5-8(10(13)14)12-15-9/h1-5H,(H,13,14)
InChI Key:
CRTZVRLESCICCT-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1onc(c1)C(=O)O
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.004g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
223.612g/mol
Monoisotopic Mass:
223.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties