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139479-06-4

139479-06-4 | Benzenediazonium, 4-(phenylamino)-, methanesulfonate, polymer with formaldehyde and 4-(phenylamino)benzoic acid (9CI)

CAS No: 139479-06-4 Catalog No: AG001B30 MDL No:MFCD13186109

Product Description

Catalog Number:
AG001B30
Chemical Name:
Benzenediazonium, 4-(phenylamino)-, methanesulfonate, polymer with formaldehyde and 4-(phenylamino)benzoic acid (9CI)
CAS Number:
139479-06-4
Molecular Formula:
C12H11N3O4S
Molecular Weight:
293.2984
MDL Number:
MFCD13186109
IUPAC Name:
4-anilinobenzenediazonium;hydrogen sulfate
InChI:
InChI=1S/C12H10N3.H2O4S/c13-15-12-8-6-11(7-9-12)14-10-4-2-1-3-5-10;1-5(2,3)4/h1-9,14H;(H2,1,2,3,4)/q+1;/p-1
InChI Key:
FMRQRWPEQSPSDG-UHFFFAOYSA-M
SMILES:
[O-]S(=O)(=O)O.N#[N+]c1ccc(cc1)Nc1ccccc1
EC Number:
224-756-8

Properties

Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.047g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
293.297g/mol
Monoisotopic Mass:
293.047g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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