Home Carboxys 2-(Phenylamino)pyrimidine-5-carboxylic acid

2-(Phenylamino)pyrimidine-5-carboxylic acid

CAS No.:
450368-25-9
Catalog Number:
AG00DCP4
Molecular Formula:
C11H9N3O2
Molecular Weight:
215.2081
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$129
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Product Description
Catalog Number:
AG00DCP4
Chemical Name:
2-(Phenylamino)pyrimidine-5-carboxylic acid
CAS Number:
450368-25-9
Molecular Formula:
C11H9N3O2
Molecular Weight:
215.2081
MDL Number:
MFCD09864415
IUPAC Name:
2-anilinopyrimidine-5-carboxylic acid
InChI:
InChI=1S/C11H9N3O2/c15-10(16)8-6-12-11(13-7-8)14-9-4-2-1-3-5-9/h1-7H,(H,15,16)(H,12,13,14)
InChI Key:
ZPIYMRAJXNMUPE-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc(nc1)Nc1ccccc1
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.069g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
215.212g/mol
Monoisotopic Mass:
215.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
75.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties