Cas no 1240621-63-9 (2-Chloro-4-(chloromethyl)-1,3-oxazole)
1240621-63-9 structure
Product Name:2-Chloro-4-(chloromethyl)-1,3-oxazole
CAS No:1240621-63-9
MF:C4H3Cl2NO
MW:151.978718996048
CID:2760332
PubChem ID:72212975
Update Time:2025-04-21
2-Chloro-4-(chloromethyl)-1,3-oxazole Chemical and Physical Properties
Names and Identifiers
-
- AB71583
- 2-CHLORO-4-(CHLOROMETHYL)-1,3-OXAZOLE
- 2-CHLORO-4-(CHLOROMETHYL)OXAZOLE
- 1240621-63-9
- 2-Chloro-4-(chloromethyl)-1,3-oxazole
-
- Inchi： 1S/C4H3Cl2NO/c5-1-3-2-8-4(6)7-3/h2H,1H2
- InChI Key： XZFNORUVJGMDCZ-UHFFFAOYSA-N
- SMILES： ClCC1=COC(=N1)Cl
Computed Properties
- Exact Mass: 150.9591691Da
- Monoisotopic Mass: 150.9591691Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 1
- Complexity: 80.4
- 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: 1.7
- Topological Polar Surface Area: 26?2
2-Chloro-4-(chloromethyl)-1,3-oxazole Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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