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31091-50-6 | Naphthalenesulfonic acid, dimethyl-
CAS No: 31091-50-6 Catalog No: AG003243 MDL No:
Product Description
Catalog Number:
AG003243
Chemical Name:
Naphthalenesulfonic acid, dimethyl-
CAS Number:
31091-50-6
Molecular Formula:
C12H12O3S
Molecular Weight:
236.2869
IUPAC Name:
2,3-dimethylnaphthalene-1-sulfonic acid
InChI:
InChI=1S/C12H12O3S/c1-8-7-10-5-3-4-6-11(10)12(9(8)2)16(13,14)15/h3-7H,1-2H3,(H,13,14,15)
InChI Key:
SDRWSOSZWGTKEF-UHFFFAOYSA-N
SMILES:
Cc1cc2ccccc2c(c1C)S(=O)(=O)O
EC Number:
250-461-9
UNII:
74T86611TJ
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.051g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.285g/mol
Monoisotopic Mass:
236.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Self-assembly in linker-modified microemulsions. | Journal of colloid and interface science 20040615 |
| Formulating chlorinated hydrocarbon microemulsions using linker molecules. | Environmental science & technology 20021101 |
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