Cas no 215649-72-2 (Acetamide,2-[(2-hydroxyethyl)amino]-N-[3-(trifluoromethoxy)phenyl]-)
215649-72-2 structure
Product Name:Acetamide,2-[(2-hydroxyethyl)amino]-N-[3-(trifluoromethoxy)phenyl]-
CAS No:215649-72-2
MF:C11H13F3N2O3
MW:278.227733373642
CID:243158
PubChem ID:15400024
Update Time:2025-04-19
Acetamide,2-[(2-hydroxyethyl)amino]-N-[3-(trifluoromethoxy)phenyl]- Chemical and Physical Properties
Names and Identifiers
-
- Acetamide,2-[(2-hydroxyethyl)amino]-N-[3-(trifluoromethoxy)phenyl]-
- 2-(2-hydroxyethylamino)-N-[3-(trifluoromethoxy)phenyl]acetamide
- 2-(2-HYDROXYETHYLAMINO)-N-(3-(TRIFLUOROMETHOXY)PHENYL)ACETAMIDE
- AG-E-58033
- AGN-PC-00P4KP
- CTK4E7145
- KB-124277
- 2-((2-Hydroxyethyl)amino)-N-(3-(trifluoromethoxy)phenyl)acetamide
- DTXSID60572415
- 215649-72-2
- N~2~-(2-Hydroxyethyl)-N-[3-(trifluoromethoxy)phenyl]glycinamide
-
- Inchi: 1S/C11H13F3N2O3/c12-11(13,14)19-9-3-1-2-8(6-9)16-10(18)7-15-4-5-17/h1-3,6,15,17H,4-5,7H2,(H,16,18)
- InChI Key: XMZWDWKEOIVJAZ-UHFFFAOYSA-N
- SMILES: FC(OC1=CC=CC(=C1)NC(CNCCO)=O)(F)F
Computed Properties
- Exact Mass: 278.08800
- Monoisotopic Mass: 278.08782677g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 19
- Rotatable Bond Count: 6
- Complexity: 287
- 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: 1.2
- Topological Polar Surface Area: 70.6?2
Experimental Properties
- PSA: 70.59000
- LogP: 1.56950
Acetamide,2-[(2-hydroxyethyl)amino]-N-[3-(trifluoromethoxy)phenyl]- Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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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. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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