Cas no 4878-20-0 (2-(4-chlorophenoxy)propanoyl Chloride)
4878-20-0 structure
Product Name:2-(4-chlorophenoxy)propanoyl Chloride
CAS No:4878-20-0
MF:C9H8Cl2O2
MW:219.06462097168
CID:2697048
PubChem ID:10911038
Update Time:2025-04-21
2-(4-chlorophenoxy)propanoyl Chloride Chemical and Physical Properties
Names and Identifiers
-
- OTNNCYBJOMYVRC-UHFFFAOYSA-N
- Propanoyl chloride, 2-(4-chlorophenoxy)-
- SCHEMBL8761273
- AKOS002392466
- 2-(4-chlorophenoxy)propanoyl Chloride
- 2-(4-chlorophenoxy)-propionyl chloride
- 4878-20-0
-
- Inchi： 1S/C9H8Cl2O2/c1-6(9(11)12)13-8-4-2-7(10)3-5-8/h2-6H,1H3
- InChI Key： OTNNCYBJOMYVRC-UHFFFAOYSA-N
- SMILES： ClC(C(C)OC1C=CC(=CC=1)Cl)=O
Computed Properties
- Exact Mass: 217.9901349Da
- Monoisotopic Mass: 217.9901349Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 176
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.3
- Topological Polar Surface Area: 26.3?2
2-(4-chlorophenoxy)propanoyl Chloride Related Literature
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
-
Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
-
Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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