Home Carboxys 5-(2-Pyridyl)isoxazole-3-carboxylic acid

5-(2-Pyridyl)isoxazole-3-carboxylic acid

CAS No.:
893638-37-4
Catalog Number:
AG003M46
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>97%
In Stock USA
United States
$505
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Product Description
Catalog Number:
AG003M46
Chemical Name:
5-(2-Pyridyl)isoxazole-3-carboxylic acid
CAS Number:
893638-37-4
Molecular Formula:
C9H6N2O3
Molecular Weight:
190.1555
MDL Number:
MFCD07377113
IUPAC Name:
5-pyridin-2-yl-1,2-oxazole-3-carboxylic acid
InChI:
InChI=1S/C9H6N2O3/c12-9(13)7-5-8(14-11-7)6-3-1-2-4-10-6/h1-5H,(H,12,13)
InChI Key:
QFFJIQXUQHIATM-UHFFFAOYSA-N
SMILES:
OC(=O)c1noc(c1)c1ccccn1
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.038g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.158g/mol
Monoisotopic Mass:
190.038g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties