Cas no 769-37-9 (Benzene, 1-chloro-2,3,4,5-tetrafluoro-)
769-37-9 structure
Product Name:Benzene, 1-chloro-2,3,4,5-tetrafluoro-
CAS No:769-37-9
MF:C6HClF4
MW:184.518754720688
CID:537004
PubChem ID:18521355
Update Time:2025-04-19
Benzene, 1-chloro-2,3,4,5-tetrafluoro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-chloro-2,3,4,5-tetrafluoro-
- 1-chloro-2,3,4,5-tetrafluorobenzene
- SCHEMBL1042005
- DTXSID20594395
- 2,3,4,5-tetrafluorochlorobenzene
- 769-37-9
-
- Inchi： 1S/C6HClF4/c7-2-1-3(8)5(10)6(11)4(2)9/h1H
- InChI Key： REYPREDAEPMPDG-UHFFFAOYSA-N
- SMILES： ClC1=CC(=C(C(=C1F)F)F)F
Computed Properties
- Exact Mass: 183.97033
- Monoisotopic Mass: 183.9702904g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 143
- 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: 3.1
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Benzene, 1-chloro-2,3,4,5-tetrafluoro- Related Literature
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
-
Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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