Cas no 74182-45-9 (ethyl 6-bromo-2-oxo-1,3-benzoxazole-3(2H)-carboxylate)
74182-45-9 structure
Product Name:ethyl 6-bromo-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
CAS No:74182-45-9
MF:C10H8BrNO4
MW:286.078822135925
CID:1769844
PubChem ID:52955
Update Time:2025-04-21
ethyl 6-bromo-2-oxo-1,3-benzoxazole-3(2H)-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- ethyl 6-bromo-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
- ethyl 6-bromo-2-oxo-1,3-benzoxazole-3-carboxylate
- 6-Bromo-3-etoksykarbonylobenzoksazolinon-2
- AKOS025172497
- SR-01000078254-1
- CCG-103390
- 74182-45-9
- SR-01000078254
- Oprea1_207539
- 6-Bromo-3-etoksykarbonylobenzoksazolinon-2 [Polish]
- HMS1607F19
- DTXSID80225158
- 3(2H)-BENZOXAZOLECARBOXYLIC ACID, 6-BROMO-2-OXO-, ETHYL ESTER
- 6-Bromo-2-oxo-3(2H)-benzoxazolecarboxylic acid ethyl ester
-
- Inchi： 1S/C10H8BrNO4/c1-2-15-9(13)12-7-4-3-6(11)5-8(7)16-10(12)14/h3-5H,2H2,1H3
- InChI Key： IIQXDOBAOJWNQM-UHFFFAOYSA-N
- SMILES： BrC1C=CC2=C(C=1)OC(N2C(=O)OCC)=O
Computed Properties
- Exact Mass: 284.96367g/mol
- Monoisotopic Mass: 284.96367g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 309
- 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: 2.6
- Topological Polar Surface Area: 55.8?2
ethyl 6-bromo-2-oxo-1,3-benzoxazole-3(2H)-carboxylate Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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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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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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