Cas no 13332-11-1 (Benzene, 2-chloro-1,3,4-trifluoro-5-methoxy-)
13332-11-1 structure
Product Name:Benzene, 2-chloro-1,3,4-trifluoro-5-methoxy-
CAS No:13332-11-1
MF:C7H4ClF3O
MW:196.554271697998
CID:1232823
PubChem ID:53416215
Update Time:2025-04-20
Benzene, 2-chloro-1,3,4-trifluoro-5-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 2-chloro-1,3,4-trifluoro-5-methoxy-
- 4-Chloro-2,3,5-trifluoroanisole
- 13332-11-1
-
- Inchi： 1S/C7H4ClF3O/c1-12-4-2-3(9)5(8)7(11)6(4)10/h2H,1H3
- InChI Key： RGSVDWCRMZXJLW-UHFFFAOYSA-N
- SMILES： ClC1C(=CC(=C(C=1F)F)OC)F
Computed Properties
- Exact Mass: 195.9902769g/mol
- Monoisotopic Mass: 195.9902769g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 158
- 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: 2.8
- Topological Polar Surface Area: 9.2?2
Benzene, 2-chloro-1,3,4-trifluoro-5-methoxy- Related Literature
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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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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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