Cas no 67083-22-1 (n-(2,6-Dimethyl-4-nitrophenyl)-4-methylbenzenesulfonamide)
67083-22-1 structure
Product Name:n-(2,6-Dimethyl-4-nitrophenyl)-4-methylbenzenesulfonamide
CAS No:67083-22-1
MF:C15H16N2O4S
MW:320.363542556763
CID:965353
PubChem ID:263000
Update Time:2025-04-19
n-(2,6-Dimethyl-4-nitrophenyl)-4-methylbenzenesulfonamide Chemical and Physical Properties
Names and Identifiers
-
- N-(2,6-dimethyl-4-nitrophenyl)-4-methylbenzenesulfonamide
- MLS002703379
- DTXSID50294573
- CHEMBL1704200
- 67083-22-1
- NSC-97147
- NSC101581
- FMQFWJMJTOKIET-UHFFFAOYSA-N
- NSC97147
- SMR001570098
- SCHEMBL10623079
- 1-(p-Toluenesulfonamido)-2,6-dimethyl-4-nitrobenzene
- NSC-101581
- n-(2,6-Dimethyl-4-nitrophenyl)-4-methylbenzenesulfonamide
-
- Inchi: 1S/C15H16N2O4S/c1-10-4-6-14(7-5-10)22(20,21)16-15-11(2)8-13(17(18)19)9-12(15)3/h4-9,16H,1-3H3
- InChI Key: FMQFWJMJTOKIET-UHFFFAOYSA-N
- SMILES: S(C1C=CC(C)=CC=1)(NC1C(C)=CC(=CC=1C)[N+](=O)[O-])(=O)=O
Computed Properties
- Exact Mass: 320.08307817g/mol
- Monoisotopic Mass: 320.08307817g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 22
- Rotatable Bond Count: 3
- Complexity: 477
- 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: 3.4
- Topological Polar Surface Area: 100?2
n-(2,6-Dimethyl-4-nitrophenyl)-4-methylbenzenesulfonamide Related Literature
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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