1-(o-Tolyl)Biguanide


Chemical Name: 1-(o-Tolyl)Biguanide
CAS Number: 93-69-6
Product Number: AG00IKGW(AGN-PC-0WA3YQ)
Synonyms:
MDL No:
Molecular Formula: C9H13N5
Molecular Weight: 191.23302

Identification/Properties


Computed Properties
Molecular Weight:
191.238g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
191.117g/mol
Monoisotopic Mass:
191.117g/mol
Topological Polar Surface Area:
103A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
242
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


GHS Pictogram:
Signal Word:
Danger
UN#:
1759
Hazard Statements:
H302-H315-H318-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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