Cas no 61174-31-0 (Benzenamine, 2-[(3-methoxyphenyl)sulfonyl]-)
![Benzenamine, 2-[(3-methoxyphenyl)sulfonyl]- structure](https://ossimg.kuujia.com/scimg/61500/61174-31-0x500.png)
61174-31-0 structure
Product Name:Benzenamine, 2-[(3-methoxyphenyl)sulfonyl]-
CAS No:61174-31-0
MF:C13H13NO3S
MW:263.312222242355
CID:489614
PubChem ID:21754011
Update Time:2025-04-19
Benzenamine, 2-[(3-methoxyphenyl)sulfonyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine, 2-[(3-methoxyphenyl)sulfonyl]-
- 2-(3-methoxyphenyl)sulfonylaniline
- DTXSID40617717
- 61174-31-0
- 2-(3-Methoxybenzene-1-sulfonyl)aniline
-
- Inchi： 1S/C13H13NO3S/c1-17-10-5-4-6-11(9-10)18(15,16)13-8-3-2-7-12(13)14/h2-9H,14H2,1H3
- InChI Key： GDIXKRSLAGJQTG-UHFFFAOYSA-N
- SMILES： S(C1C=CC=C(C=1)OC)(C1C=CC=CC=1N)(=O)=O
Computed Properties
- Exact Mass: 263.06169
- Monoisotopic Mass: 263.06161445g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 363
- 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: 2.2
- Topological Polar Surface Area: 77.8?2
Experimental Properties
- PSA: 69.39
Benzenamine, 2-[(3-methoxyphenyl)sulfonyl]- Related Literature
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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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
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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