Cas no 2211-99-6 (Benzenesulfonic acid,4-(1-methylundecyl)-, sodium salt (1:1))
2211-99-6 structure
Product Name:Benzenesulfonic acid,4-(1-methylundecyl)-, sodium salt (1:1)
CAS No:2211-99-6
MF:C18H29NaO3S
MW:348.475835561752
CID:269599
PubChem ID:23691965
Update Time:2025-04-19
Benzenesulfonic acid,4-(1-methylundecyl)-, sodium salt (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonic acid,4-(1-methylundecyl)-, sodium salt (1:1)
- 4-dodecan-2-ylbenzenesulfonic acid
- Benzenesulfonic acid, 4-(1-methylundecyl)-, sodium salt (1:1)
- T2TZZ07610
- sodium;4-dodecan-2-ylbenzenesulfonate
- Sodium (1-methylundecyl)benzenesulfonate
- LINEAR ALKYL BENZENESULPHONATE(MIXTURES)
- Sodium (2-dodecyl)benzenesulfonate
- SCHEMBL2702666
- 68628-60-4
- Sodium 4-(1-methylundecyl)benzenesulfonate
- D89883
- Sodium 4-sec-dodecylbenzenesulphonate
- DTXSID00274022
- NSC-152936
- SODIUM 4-SEC-DODECYLBENZENESULFONATE
- Q27289590
- AT39872
- 2211-99-6
- alkyl benzyl sulfonate
- Benzenesulfonic acid, 4-(1-methylundecyl)-, sodium salt
- sodium p-(1-methylundecyl)benzenesulfonate
- 42615-29-2
- NSC 152936
- Benzenesulfonic aicd, 4-(1-methylundecyl)-, sodium salt
- UNII-T2TZZ07610
-
- Inchi： 1S/C18H30O3S.Na/c1-3-4-5-6-7-8-9-10-11-16(2)17-12-14-18(15-13-17)22(19,20)21;/h12-16H,3-11H2,1-2H3,(H,19,20,21);/q;+1/p-1
- InChI Key： GHRHULTYHYEOQB-UHFFFAOYSA-M
- SMILES： S(C1C=CC(=CC=1)C(C)CCCCCCCCCC)(=O)(=O)[O-].[Na+]
Computed Properties
- Exact Mass: 326.1917
- Monoisotopic Mass: 348.174
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 23
- Rotatable Bond Count: 11
- Complexity: 370
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 65.6A^2
Experimental Properties
- Color/Form: Thin white needle
- Density: 1.409
- Melting Point: 50-51 DEG C (ANHYDROUS)
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.507
- PSA: 54.37
- LogP: 6.64840
Benzenesulfonic acid,4-(1-methylundecyl)-, sodium salt (1:1) Security Information
- Storage Condition：Keep in a cool, dry, dark place, in a sealed container or cylinder. Keep away from incompatible materials, sources of ignition, and untrained people. Safety label area. Protect container / cylinder from physical injury.
Benzenesulfonic acid,4-(1-methylundecyl)-, sodium salt (1:1) Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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