Home Carboxys 3-hydroxy-5-phenylpyrazine-2-carboxylic acid

3-hydroxy-5-phenylpyrazine-2-carboxylic acid

CAS No.:
41270-60-4
Catalog Number:
AG01B6AO
Molecular Formula:
C11H8N2O3
Molecular Weight:
216.1928
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01B6AO
Chemical Name:
3-hydroxy-5-phenylpyrazine-2-carboxylic acid
CAS Number:
41270-60-4
Molecular Formula:
C11H8N2O3
Molecular Weight:
216.1928
MDL Number:
MFCD24480706
IUPAC Name:
2-oxo-6-phenyl-1H-pyrazine-3-carboxylic acid
InChI:
InChI=1S/C11H8N2O3/c14-10-9(11(15)16)12-6-8(13-10)7-4-2-1-3-5-7/h1-6H,(H,13,14)(H,15,16)
InChI Key:
BEXNHBOBDYVGHS-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncc(nc1O)c1ccccc1
Properties
Complexity:
379  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.053g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
216.196g/mol
Monoisotopic Mass:
216.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties