Home Carboxys methyl 5-carbamimidoylpyridine-3-carboxylate hydrochloride

methyl 5-carbamimidoylpyridine-3-carboxylate hydrochloride

CAS No.:
2059988-28-0
Catalog Number:
AG01BR38
Molecular Formula:
C8H10ClN3O2
Molecular Weight:
215.6369
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Product Description
Catalog Number:
AG01BR38
Chemical Name:
methyl 5-carbamimidoylpyridine-3-carboxylate hydrochloride
CAS Number:
2059988-28-0
Molecular Formula:
C8H10ClN3O2
Molecular Weight:
215.6369
MDL Number:
MFCD30502206
IUPAC Name:
methyl 5-carbamimidoylpyridine-3-carboxylate;hydrochloride
InChI:
InChI=1S/C8H9N3O2.ClH/c1-13-8(12)6-2-5(7(9)10)3-11-4-6;/h2-4H,1H3,(H3,9,10);1H
InChI Key:
CPFXCPGXLOWKDB-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(cnc1)C(=N)N.Cl
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.046g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
215.637g/mol
Monoisotopic Mass:
215.046g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
89.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties