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89-08-7 | 4-SULFOPHTHALIC ACID
CAS No: 89-08-7 Catalog No: AG003M10 MDL No:MFCD00007494
Product Description
Catalog Number:
AG003M10
Chemical Name:
4-SULFOPHTHALIC ACID
CAS Number:
89-08-7
Molecular Formula:
C8H6O7S
Molecular Weight:
246.1940
MDL Number:
MFCD00007494
IUPAC Name:
4-sulfophthalic acid
InChI:
InChI=1S/C8H6O7S/c9-7(10)5-2-1-4(16(13,14)15)3-6(5)8(11)12/h1-3H,(H,9,10)(H,11,12)(H,13,14,15)
InChI Key:
WNKQDGLSQUASME-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(ccc1C(=O)O)S(=O)(=O)O
EC Number:
201-881-6
UNII:
T1SM5DOM66
NSC Number:
100615
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.983g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
246.189g/mol
Monoisotopic Mass:
245.983g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
Literature
| Title | Journal |
|---|---|
| Poly[[diaqua-(1,10-phenanthroline-κN,N')(μ(3)-4-sulfonato-benzene-1,2-dicarboxyl-ato-κO:O,O:O)dysprosium(III)] dihydrate]. | Acta crystallographica. Section E, Structure reports online 20120301 |
| Poly[[diaqua-(1,10-phenanthroline-κN,N')(μ(3)-4-sulfonato-benzene-1,2-di-car-boxyl-ato-κO:O,O:O)erbium(III)] dihydrate]. | Acta crystallographica. Section E, Structure reports online 20120201 |
| Separation of isomers of sulfophthalic acid by guest induced host framework formation with 4,4'-bipyridine. | Chemical communications (Cambridge, England) 20110621 |
| UV-vis absorption properties of polyazomethine in base and protonated with 1,2-(di-2-ethylhexyl)ester of 4-sulfophthalic acid form. | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20090915 |
| Preparative separation of isomeric sulfophthalic acids by conventional and pH-zone-refining counter-current chromatography. | Journal of chromatography. A 20020809 |
| Concerted chemical and microbial degradation of sulfophthalimides formed from sulfophthalocyanine dyes by white-rot fungi. | Environmental science & technology 20011201 |
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