Cas no 89303-52-6 (Benzene, 4-(methylsulfonyl)-2-nitro-1-[(phenylsulfonyl)methyl]-)
89303-52-6 structure
Product Name:Benzene, 4-(methylsulfonyl)-2-nitro-1-[(phenylsulfonyl)methyl]-
CAS No:89303-52-6
MF:C14H13NO6S2
MW:355.386121511459
CID:604831
PubChem ID:13256978
Update Time:2025-04-19
Benzene, 4-(methylsulfonyl)-2-nitro-1-[(phenylsulfonyl)methyl]- Chemical and Physical Properties
Names and Identifiers
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- Benzene, 4-(methylsulfonyl)-2-nitro-1-[(phenylsulfonyl)methyl]-
- 1-(benzenesulfonylmethyl)-4-methylsulfonyl-2-nitrobenzene
- DTXSID10532423
- 1-[(Benzenesulfonyl)methyl]-4-(methanesulfonyl)-2-nitrobenzene
- 89303-52-6
-
- Inchi: 1S/C14H13NO6S2/c1-22(18,19)13-8-7-11(14(9-13)15(16)17)10-23(20,21)12-5-3-2-4-6-12/h2-9H,10H2,1H3
- InChI Key: BGGIDFSRJOHNOU-UHFFFAOYSA-N
- SMILES: S(C1C=CC=CC=1)(CC1C=CC(=CC=1[N+](=O)[O-])S(C)(=O)=O)(=O)=O
Computed Properties
- Exact Mass: 355.01842948g/mol
- Monoisotopic Mass: 355.01842948g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 23
- Rotatable Bond Count: 4
- Complexity: 620
- 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: 1.7
- Topological Polar Surface Area: 131?2
Benzene, 4-(methylsulfonyl)-2-nitro-1-[(phenylsulfonyl)methyl]- Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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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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4. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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