Home Halogens methyl 6-bromo-5-chloropyrazine-2-carboxylate

methyl 6-bromo-5-chloropyrazine-2-carboxylate

CAS No.:
1017603-87-0
Catalog Number:
AG01DSYJ
Molecular Formula:
C6H4BrClN2O2
Molecular Weight:
251.4652
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Product Description
Catalog Number:
AG01DSYJ
Chemical Name:
methyl 6-bromo-5-chloropyrazine-2-carboxylate
CAS Number:
1017603-87-0
Molecular Formula:
C6H4BrClN2O2
Molecular Weight:
251.4652
MDL Number:
MFCD31559718
IUPAC Name:
methyl 6-bromo-5-chloropyrazine-2-carboxylate
InChI:
InChI=1S/C6H4BrClN2O2/c1-12-6(11)3-2-9-5(8)4(7)10-3/h2H,1H3
InChI Key:
PMNRFTVMUXRTFN-UHFFFAOYSA-N
SMILES:
COC(=O)c1cnc(c(n1)Br)Cl
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.914g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.464g/mol
Monoisotopic Mass:
249.914g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties