Home Carboxys 5-carbamoylpyrazine-2-carboxylic acid

5-carbamoylpyrazine-2-carboxylic acid

CAS No.:
117890-32-1
Catalog Number:
AG01DYGK
Molecular Formula:
C6H5N3O3
Molecular Weight:
167.1222
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$448
- +
5g
95%
In Stock USA
United States
$1462
- +
Product Description
Catalog Number:
AG01DYGK
Chemical Name:
5-carbamoylpyrazine-2-carboxylic acid
CAS Number:
117890-32-1
Molecular Formula:
C6H5N3O3
Molecular Weight:
167.1222
MDL Number:
MFCD22393849
IUPAC Name:
5-carbamoylpyrazine-2-carboxylic acid
InChI:
InChI=1S/C6H5N3O3/c7-5(10)3-1-9-4(2-8-3)6(11)12/h1-2H,(H2,7,10)(H,11,12)
InChI Key:
ZIMOOJPJWDBGGB-UHFFFAOYSA-N
SMILES:
NC(=O)c1cnc(cn1)C(=O)O
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.033g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
167.124g/mol
Monoisotopic Mass:
167.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1  
Properties