Home Carboxys methyl 1-(pyrazin-2-yl)-1H-imidazole-4-carboxylate

methyl 1-(pyrazin-2-yl)-1H-imidazole-4-carboxylate

CAS No.:
1702590-82-6
Catalog Number:
AG01BED9
Molecular Formula:
C9H8N4O2
Molecular Weight:
204.1854
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Product Description
Catalog Number:
AG01BED9
Chemical Name:
methyl 1-(pyrazin-2-yl)-1H-imidazole-4-carboxylate
CAS Number:
1702590-82-6
Molecular Formula:
C9H8N4O2
Molecular Weight:
204.1854
MDL Number:
MFCD28064051
IUPAC Name:
methyl 1-pyrazin-2-ylimidazole-4-carboxylate
InChI:
InChI=1S/C9H8N4O2/c1-15-9(14)7-5-13(6-12-7)8-4-10-2-3-11-8/h2-6H,1H3
InChI Key:
BEHQJTHVXHPEFW-UHFFFAOYSA-N
SMILES:
COC(=O)c1ncn(c1)c1cnccn1
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.065g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.189g/mol
Monoisotopic Mass:
204.065g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
69.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties