Cas no 101513-72-8 (3,5-Dichloro-2,4-difluorobenzoyl chloride)
101513-72-8 structure
Product Name:3,5-Dichloro-2,4-difluorobenzoyl chloride
CAS No:101513-72-8
MF:C7HCl3F2O
MW:245.438046216965
CID:62237
PubChem ID:13565019
Update Time:2025-04-18
3,5-Dichloro-2,4-difluorobenzoyl chloride Chemical and Physical Properties
Names and Identifiers
-
- 3,5-Dichloro-2,4-difluorobenzoyl chloride
- 3,5-DICHLORO-2,4-DIFLUORO-BENZOYL CHLORIDE
- Benzoyl chloride,3,5-dichloro-2,4-difluoro
- SCHEMBL8727193
- FT-0645695
- AKOS015891195
- DTXSID20543944
- 101513-72-8
- Benzoyl chloride, 3,5-dichloro-2,4-difluoro-
- 3,5-Dichloro-2,4-difluorobenzoylchloride
-
- Inchi： 1S/C7HCl3F2O/c8-3-1-2(7(10)13)5(11)4(9)6(3)12/h1H
- InChI Key： ASQQXYQZMYOGIL-UHFFFAOYSA-N
- SMILES： ClC1=C(C(=CC(C(=O)Cl)=C1F)Cl)F
Computed Properties
- Exact Mass: 243.90600
- Monoisotopic Mass: 243.906104g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 214
- 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: 3.9
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- Density: 1.656
- Boiling Point: 238 oC
- Flash Point: 98 oC
- Refractive Index: 1.537
- PSA: 17.07000
- LogP: 3.65060
3,5-Dichloro-2,4-difluorobenzoyl chloride Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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