Home Sulfos 1H-imidazol-1-amine, 2,4,6-trimethylbenzene-1-sulfonic acid

1H-imidazol-1-amine, 2,4,6-trimethylbenzene-1-sulfonic acid

CAS No.:
199181-39-0
Catalog Number:
AG01AMOS
Molecular Formula:
C12H17N3O3S
Molecular Weight:
283.3467
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Product Description
Catalog Number:
AG01AMOS
Chemical Name:
1H-imidazol-1-amine, 2,4,6-trimethylbenzene-1-sulfonic acid
CAS Number:
199181-39-0
Molecular Formula:
C12H17N3O3S
Molecular Weight:
283.3467
MDL Number:
MFCD29033966
IUPAC Name:
imidazol-1-amine;2,4,6-trimethylbenzenesulfonic acid
InChI:
InChI=1S/C9H12O3S.C3H5N3/c1-6-4-7(2)9(8(3)5-6)13(10,11)12;4-6-2-1-5-3-6/h4-5H,1-3H3,(H,10,11,12);1-3H,4H2
InChI Key:
BJXQUZUPFYJFPP-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1)C)S(=O)(=O)O.Nn1cncc1
Properties
Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.099g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
283.346g/mol
Monoisotopic Mass:
283.099g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties