Cas no 5138-53-4 (2-Naphthalenesulfonic acid, methyl ester)
5138-53-4 structure
Product Name:2-Naphthalenesulfonic acid, methyl ester
CAS No:5138-53-4
MF:C11H10O3S
MW:222.260302066803
CID:1575030
PubChem ID:12757892
Update Time:2025-04-21
2-Naphthalenesulfonic acid, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Naphthalenesulfonic acid, methyl ester
- methyl naphthalene-2-sulfonate
- 5138-53-4
- AFVPRVLDAPXRCX-UHFFFAOYSA-N
- DTXSID20509106
- SCHEMBL3633735
-
- Inchi： 1S/C11H10O3S/c1-14-15(12,13)11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3
- InChI Key： AFVPRVLDAPXRCX-UHFFFAOYSA-N
- SMILES： S(C1C=CC2C=CC=CC=2C=1)(=O)(=O)OC
Computed Properties
- Exact Mass: 222.0351
- Monoisotopic Mass: 222.03506535g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 304
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.2
- Topological Polar Surface Area: 51.8?2
Experimental Properties
- PSA: 43.37
2-Naphthalenesulfonic acid, methyl ester Related Literature
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
-
M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
5138-53-4 (2-Naphthalenesulfonic acid, methyl ester) Related Products
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