Home Carboxys 5-(dimethylamino)pyrazine-2-carboxylic acid

5-(dimethylamino)pyrazine-2-carboxylic acid

CAS No.:
1302581-08-3
Catalog Number:
AG01A3XH
Molecular Formula:
C7H9N3O2
Molecular Weight:
167.1653
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Product Description
Catalog Number:
AG01A3XH
Chemical Name:
5-(dimethylamino)pyrazine-2-carboxylic acid
CAS Number:
1302581-08-3
Molecular Formula:
C7H9N3O2
Molecular Weight:
167.1653
MDL Number:
MFCD20284516
IUPAC Name:
5-(dimethylamino)pyrazine-2-carboxylic acid
InChI:
InChI=1S/C7H9N3O2/c1-10(2)6-4-8-5(3-9-6)7(11)12/h3-4H,1-2H3,(H,11,12)
InChI Key:
QJHKHNOXWWAERJ-UHFFFAOYSA-N
SMILES:
CN(c1ncc(nc1)C(=O)O)C
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.069g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.168g/mol
Monoisotopic Mass:
167.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties