Cas no 15404-00-9 (Benzenesulfonic acid, 4-methyl-, compd. with N,N-diethylethanamine (1:1))
15404-00-9 structure
Product Name:Benzenesulfonic acid, 4-methyl-, compd. with N,N-diethylethanamine (1:1)
CAS No:15404-00-9
MF:C13H23NO3S
MW:273.391622781754
CID:200135
PubChem ID:161127
Update Time:2025-04-19
Benzenesulfonic acid, 4-methyl-, compd. with N,N-diethylethanamine (1:1) Chemical and Physical Properties
Names and Identifiers
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- Benzenesulfonic acid, 4-methyl-, compd. with N,N-diethylethanamine (1:1)
- N,N-diethylethanamine,4-methylbenzenesulfonic acid
- triethylammonium p-toluenesulphonate
- 4-Methylbenzenesulfonic acid, triethylamine salt
- N,N-diethylethanamine 4-methylbenzenesulfonate (1:1)
- N,N-Diethylethanamine, 4-methylbenzenesulfonate
- Einecs 239-421-1
- Triethylammonium p-toluenesulfonate
- p-toluenesulfonic acid triethylamine salt
- MMVUZMIOJNPDME-UHFFFAOYSA-N
- triethylamine p-toluenesulphonate
- DTXSID7065883
- triethyl ammonium tosylate
- N,N-diethylethanamine;4-methylbenzenesulfonic acid
- Benzenesulfonic acid, 4-methyl-, compd. with N,N-diethylethanamine
- 15404-00-9
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- Inchi： 1S/C7H8O3S.C6H15N/c1-6-2-4-7(5-3-6)11(8,9)10;1-4-7(5-2)6-3/h2-5H,1H3,(H,8,9,10);4-6H2,1-3H3
- InChI Key： MMVUZMIOJNPDME-UHFFFAOYSA-N
- SMILES： S(C1C=CC(C)=CC=1)(=O)(=O)O.N(CC)(CC)CC
Computed Properties
- Exact Mass: 273.13999
- Monoisotopic Mass: 273.14
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 232
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 66?2
Experimental Properties
- Density: g/cm3
- Boiling Point: 399.4°Cat760mmHg
- Flash Point: 195.4°C
- PSA: 57.61
Benzenesulfonic acid, 4-methyl-, compd. with N,N-diethylethanamine (1:1) Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
15404-00-9 (Benzenesulfonic acid, 4-methyl-, compd. with N,N-diethylethanamine (1:1)) Related Products
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