Cas no 832076-76-3 (Oxazole, 2-(3-chlorophenyl)-4,5-dimethyl-)
832076-76-3 structure
Product Name:Oxazole, 2-(3-chlorophenyl)-4,5-dimethyl-
CAS No:832076-76-3
MF:C11H10ClNO
MW:207.656201839447
CID:677072
PubChem ID:12158084
Update Time:2025-04-19
Oxazole, 2-(3-chlorophenyl)-4,5-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Oxazole, 2-(3-chlorophenyl)-4,5-dimethyl-
- 2-(3-chlorophenyl)-4,5-dimethyl-1,3-oxazole
- 832076-76-3
- DTXSID80478809
- SCHEMBL5536101
-
- Inchi: 1S/C11H10ClNO/c1-7-8(2)14-11(13-7)9-4-3-5-10(12)6-9/h3-6H,1-2H3
- InChI Key: QZILABBOTGDHQD-UHFFFAOYSA-N
- SMILES: ClC1=CC=CC(=C1)C1=NC(C)=C(C)O1
Computed Properties
- Exact Mass: 207.0450916g/mol
- Monoisotopic Mass: 207.0450916g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 200
- 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: 3.4
- Topological Polar Surface Area: 26?2
Oxazole, 2-(3-chlorophenyl)-4,5-dimethyl- Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
832076-76-3 (Oxazole, 2-(3-chlorophenyl)-4,5-dimethyl-) Related Products
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