Home Sulfos Toluene-4-sulfonate5-amino-1,2,3,3-tetramethyl-3h-indolium

Toluene-4-sulfonate5-amino-1,2,3,3-tetramethyl-3h-indolium

CAS No.:
364372-16-7
Catalog Number:
AG00I77Y
Molecular Formula:
C19H24N2O3S
Molecular Weight:
360.4705
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Product Description
Catalog Number:
AG00I77Y
Chemical Name:
Toluene-4-sulfonate5-amino-1,2,3,3-tetramethyl-3h-indolium
CAS Number:
364372-16-7
Molecular Formula:
C19H24N2O3S
Molecular Weight:
360.4705
MDL Number:
MFCD06654910
IUPAC Name:
4-methylbenzenesulfonate;1,2,3,3-tetramethylindol-1-ium-5-amine
InChI:
InChI=1S/C12H17N2.C7H8O3S/c1-8-12(2,3)10-7-9(13)5-6-11(10)14(8)4;1-6-2-4-7(5-3-6)11(8,9)10/h5-7H,13H2,1-4H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1
InChI Key:
ZZYWOGMXNMOJFL-UHFFFAOYSA-M
SMILES:
Nc1ccc2c(c1)C(C)(C)C(=[N+]2C)C.Cc1ccc(cc1)S(=O)(=O)[O-]
Properties
Complexity:
471  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.151g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
360.472g/mol
Monoisotopic Mass:
360.151g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
94.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties