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Home > Nitro Compounds > 326610-63-3

326610-63-3

326610-63-3 | 2-hydroxy-4-(3-nitrobenzenesulfonamido)benzoic acid

CAS No: 326610-63-3 Catalog No: AG019GIG MDL No:MFCD02699971

Product Description

Catalog Number:
AG019GIG
Chemical Name:
2-hydroxy-4-(3-nitrobenzenesulfonamido)benzoic acid
CAS Number:
326610-63-3
Molecular Formula:
C13H10N2O7S
Molecular Weight:
338.2927
MDL Number:
MFCD02699971
IUPAC Name:
2-hydroxy-4-[(3-nitrophenyl)sulfonylamino]benzoic acid
InChI:
InChI=1S/C13H10N2O7S/c16-12-6-8(4-5-11(12)13(17)18)14-23(21,22)10-3-1-2-9(7-10)15(19)20/h1-7,14,16H,(H,17,18)
InChI Key:
WSPXQWPMWCYBPS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)S(=O)(=O)Nc1ccc(c(c1)O)C(=O)O

Properties

Complexity:
554  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.021g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
338.29g/mol
Monoisotopic Mass:
338.021g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
158A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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