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41295-98-1 | Sodium 4-amino-2,5-dichlorobenzenesulfonate
CAS No: 41295-98-1 Catalog No: AG003FXT MDL No:MFCD00068356
Product Description
Catalog Number:
AG003FXT
Chemical Name:
Sodium 4-amino-2,5-dichlorobenzenesulfonate
CAS Number:
41295-98-1
Molecular Formula:
C6H4Cl2NNaO3S
Molecular Weight:
264.0616
MDL Number:
MFCD00068356
IUPAC Name:
sodium;4-amino-2,5-dichlorobenzenesulfonate
InChI:
InChI=1S/C6H5Cl2NO3S.Na/c7-3-2-6(13(10,11)12)4(8)1-5(3)9;/h1-2H,9H2,(H,10,11,12);/q;+1/p-1
InChI Key:
MOJYHTGMAPQZMC-UHFFFAOYSA-M
SMILES:
Clc1cc(c(cc1N)Cl)S(=O)(=O)[O-].[Na+]
EC Number:
255-302-7
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.919g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.052g/mol
Monoisotopic Mass:
262.919g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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