Cas no 2943-19-3 (Benzenesulfonothioicacid, 4-methyl-, S-(1,1-dimethylethyl) ester)
2943-19-3 structure
Product Name:Benzenesulfonothioicacid, 4-methyl-, S-(1,1-dimethylethyl) ester
CAS No:2943-19-3
MF:C11H16O2S2
MW:244.373540878296
CID:279100
PubChem ID:334893
Update Time:2025-04-19
Benzenesulfonothioicacid, 4-methyl-, S-(1,1-dimethylethyl) ester Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonothioicacid, 4-methyl-, S-(1,1-dimethylethyl) ester
- 1-tert-butylsulfanylsulfonyl-4-methylbenzene
- 4-(t-Butylthio)tosylate
- AC1L7GCB
- AG-E-95854
- CTK4G3292
- NCI60_003034
- NSC342017
- S-(tert-Butyl) 4-methylbenzenesulfonothioate
- S-t-butyl 4-methylbenzenesulfonothioate
- toluene-4-thiosulfonic acid S-tert-butyl ester
- UNII-D38O9IQK3G
- P-TOLUENESULFONIC ACID, THIO-, S-TERT-BUTYL ESTER
- NSC-342017
- SCHEMBL16940169
- DTXSID80183643
- 1-tert-butylsulfanylsulfonyl-4-methyl-benzene
- D38O9IQK3G
- NSC 342017
- CHEMBL1975915
- 2943-19-3
- TERT-BUTYL TOSYL SULFIDE
- S-tert-Butyl p-toluenethiosulfonate
-
- Inchi： 1S/C11H16O2S2/c1-9-5-7-10(8-6-9)15(12,13)14-11(2,3)4/h5-8H,1-4H3
- InChI Key： DWUPUYSPVAQOBQ-UHFFFAOYSA-N
- SMILES： S(C1C=CC(C)=CC=1)(=O)(=O)SC(C)(C)C
Computed Properties
- Exact Mass: 244.05928
- Monoisotopic Mass: 244.059
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 288
- 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: 2.9
- Topological Polar Surface Area: 67.8?2
Experimental Properties
- Density: 1.158
- Boiling Point: 353.1°Cat760mmHg
- Flash Point: 167.4°C
- Refractive Index: 1.545
- PSA: 34.14
- LogP: 4.29620
Benzenesulfonothioicacid, 4-methyl-, S-(1,1-dimethylethyl) ester Related Literature
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
-
Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
-
Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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