Cas no 91013-48-8 (Ethyl 2-[(methylsulfonyl)amino]benzoate)
![Ethyl 2-[(methylsulfonyl)amino]benzoate structure](https://ossimg.kuujia.com/scimg/91500/91013-48-8x500.png)
91013-48-8 structure
Product Name:Ethyl 2-[(methylsulfonyl)amino]benzoate
CAS No:91013-48-8
MF:C10H13NO4S
MW:243.27952170372
CID:2112533
Update Time:2023-08-04
Ethyl 2-[(methylsulfonyl)amino]benzoate Chemical and Physical Properties
Names and Identifiers
-
- 2-[(methylsulfonyl)amino]Benzoic acid ethyl ester
- ethyl 2-[(methylsulfonyl)amino]benzoate
- ChemDiv3_000875
- Oprea1_759086
- Oprea1_275389
- ethyl 2-methanesulfonamidobenzoate
- ILQPXAAMGKTIPN-UHFFFAOYSA-N
- HMS1475H17
- IDI1_019841
- ST076983
- 2-methanesulfonylamino-benzoic acid ethyl ester
- 2-(Methylsulfonylamino)benzoic acid ethyl ester
- Benzoic acid, 2-[(methylsulfonyl)amino]-, ethyl ester
- Ethyl 2-[(methylsulfonyl)amino]benzoate
-
- Inchi： 1S/C10H13NO4S/c1-3-15-10(12)8-6-4-5-7-9(8)11-16(2,13)14/h4-7,11H,3H2,1-2H3
- InChI Key： ILQPXAAMGKTIPN-UHFFFAOYSA-N
- SMILES： S(C)(NC1C=CC=CC=1C(=O)OCC)(=O)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 333
- XLogP3: 2.3
- Topological Polar Surface Area: 80.8
Ethyl 2-[(methylsulfonyl)amino]benzoate Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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