1-cyano-2-methyl-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine


Chemical Name: 1-cyano-2-methyl-3-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine
CAS Number: 51481-61-9
Product Number: AG00I97O(AGN-PC-0JK6CA)
Synonyms:
MDL No: MFCD00133296
Molecular Formula: C10H17N6S
Molecular Weight: 253.3472

Identification/Properties


Properties
MP:
139-144°C
Storage:
Room Temperature;
Form:
Solid
Refractive Index:
1.5700 (estimate)
Computed Properties
Molecular Weight:
252.34g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
7
Exact Mass:
252.116g/mol
Monoisotopic Mass:
252.116g/mol
Topological Polar Surface Area:
114A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
296
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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