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24894-89-1 | Benzenesulfonic acid, 4-(dichloroamino)-
CAS No: 24894-89-1 Catalog No: AG002PSD MDL No:
Product Description
Catalog Number:
AG002PSD
Chemical Name:
Benzenesulfonic acid, 4-(dichloroamino)-
CAS Number:
24894-89-1
Molecular Formula:
C6H5Cl2NO3S
Molecular Weight:
242.0798
IUPAC Name:
4-(dichloroamino)benzenesulfonic acid
InChI:
InChI=1S/C6H5Cl2NO3S/c7-9(8)5-1-3-6(4-2-5)13(10,11)12/h1-4H,(H,10,11,12)
InChI Key:
MTIRCEAOVDFRGC-UHFFFAOYSA-N
SMILES:
ClN(c1ccc(cc1)S(=O)(=O)O)Cl
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.937g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.07g/mol
Monoisotopic Mass:
240.937g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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