Home Halogens Methyl 3-chloro-5-methylpyrazine-2-carboxylate

Methyl 3-chloro-5-methylpyrazine-2-carboxylate

CAS No.:
859063-65-3
Catalog Number:
AG008G6N
Molecular Formula:
C7H7ClN2O2
Molecular Weight:
186.5957
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Product Description
Catalog Number:
AG008G6N
Chemical Name:
Methyl 3-chloro-5-methylpyrazine-2-carboxylate
CAS Number:
859063-65-3
Molecular Formula:
C7H7ClN2O2
Molecular Weight:
186.5957
MDL Number:
MFCD10697746
IUPAC Name:
methyl 3-chloro-5-methylpyrazine-2-carboxylate
InChI:
InChI=1S/C7H7ClN2O2/c1-4-3-9-5(6(8)10-4)7(11)12-2/h3H,1-2H3
InChI Key:
PCXXNIDVYAIUHR-UHFFFAOYSA-N
SMILES:
COC(=O)c1ncc(nc1Cl)C
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.02g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.595g/mol
Monoisotopic Mass:
186.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties