Home Halogens Methyl 6-bromo-3-(methylamino)pyrazine-2-carboxylate

Methyl 6-bromo-3-(methylamino)pyrazine-2-carboxylate

CAS No.:
13457-23-3
Catalog Number:
AG00HTCE
Molecular Formula:
C7H8BrN3O2
Molecular Weight:
246.0613
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Product Description
Catalog Number:
AG00HTCE
Chemical Name:
Methyl 6-bromo-3-(methylamino)pyrazine-2-carboxylate
CAS Number:
13457-23-3
Molecular Formula:
C7H8BrN3O2
Molecular Weight:
246.0613
MDL Number:
MFCD27952581
IUPAC Name:
methyl 6-bromo-3-(methylamino)pyrazine-2-carboxylate
InChI:
InChI=1S/C7H8BrN3O2/c1-9-6-5(7(12)13-2)11-4(8)3-10-6/h3H,1-2H3,(H,9,10)
InChI Key:
UKVSTTVEIRVEMS-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc(Br)cnc1NC
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.98g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
246.064g/mol
Monoisotopic Mass:
244.98g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties