Cas no 499771-12-9 (1-[3-(2,6-DICHLOROPHENYL)ISOXAZOL-5-YL]ETHAN-1-ONE)
499771-12-9 structure
Product Name:1-[3-(2,6-DICHLOROPHENYL)ISOXAZOL-5-YL]ETHAN-1-ONE
CAS No:499771-12-9
MF:C11H7Cl2NO2
MW:256.084780931473
CID:841190
Update Time:2026-04-29
1-[3-(2,6-DICHLOROPHENYL)ISOXAZOL-5-YL]ETHAN-1-ONE Chemical and Physical Properties
Names and Identifiers
-
- 1-[3-(2,6-DICHLOROPHENYL)ISOXAZOL-5-YL]ETHAN-1-ONE
- 1-[3-(2,6-Dichlorophenyl)isoxazol-5-yl]ethanone
- AC1MCMET
- CTK4J1886
- HMS566J09
- Maybridge1_008831
- MolPort-000-146-799
- SPB07990
-
- Inchi: InChI=1S/C11H7Cl2NO2/c1-6(15)10-5-9(14-16-10)11-7(12)3-2-4-8(11)13/h2-5H,1H3
- InChI Key: JPFRJBIHUZVDFO-UHFFFAOYSA-N
- SMILES: CC(=O)C1=CC(=NO1)C2=C(C=CC=C2Cl)Cl
Computed Properties
- Exact Mass: 254.98551
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
Experimental Properties
- Melting Point: 117 °C
- PSA: 43.1
1-[3-(2,6-DICHLOROPHENYL)ISOXAZOL-5-YL]ETHAN-1-ONE Related Literature
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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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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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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