Cas no 1053102-11-6 (2-(Benzyloxy)-5-(morpholinosulfonyl)benzoic acid)
1053102-11-6 structure
Product Name:2-(Benzyloxy)-5-(morpholinosulfonyl)benzoic acid
CAS No:1053102-11-6
MF:C18H19NO6S
MW:377.41156411171
CID:2112265
Update Time:2023-08-04
2-(Benzyloxy)-5-(morpholinosulfonyl)benzoic acid Chemical and Physical Properties
Names and Identifiers
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- 2-(benzyloxy)-5-(morpholinosulfonyl)benzoic acid
- KICAYPSRUZWAJZ-UHFFFAOYSA-N
- Benzoic acid, 5-(4-morpholinylsulfonyl)-2-(phenylmethoxy)-
- 5-(4-Morpholinylsulfonyl)-2-[(phenylmethyl)oxy]benzoic acid
- 2-(Benzyloxy)-5-(morpholinosulfonyl)benzoic acid
-
- Inchi: 1S/C18H19NO6S/c20-18(21)16-12-15(26(22,23)19-8-10-24-11-9-19)6-7-17(16)25-13-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H,20,21)
- InChI Key: KICAYPSRUZWAJZ-UHFFFAOYSA-N
- SMILES: S(C1C=CC(=C(C(=O)O)C=1)OCC1C=CC=CC=1)(N1CCOCC1)(=O)=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 26
- Rotatable Bond Count: 6
- Complexity: 563
- Topological Polar Surface Area: 102
2-(Benzyloxy)-5-(morpholinosulfonyl)benzoic acid Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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