Cas no 13332-14-4 (Benzene, 1,3,4-trifluoro-2-iodo-5-methoxy-)
13332-14-4 structure
Product Name:Benzene, 1,3,4-trifluoro-2-iodo-5-methoxy-
CAS No:13332-14-4
MF:C7H4F3IO
MW:288.005744934082
CID:1236846
PubChem ID:85612185
Update Time:2025-04-20
Benzene, 1,3,4-trifluoro-2-iodo-5-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1,3,4-trifluoro-2-iodo-5-methoxy-
- 4-Iodo-2,3,5-trifluoroanisole
- 13332-14-4
-
- Inchi： 1S/C7H4F3IO/c1-12-4-2-3(8)7(11)6(10)5(4)9/h2H,1H3
- InChI Key： KVGJRTUCOZTKTI-UHFFFAOYSA-N
- SMILES： IC1C(=CC(=C(C=1F)F)OC)F
Computed Properties
- Exact Mass: 287.92590g/mol
- Monoisotopic Mass: 287.92590g/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, 1,3,4-trifluoro-2-iodo-5-methoxy- Related Literature
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Xiao Liu,Jun Xu,Yinyun Lv,Wenyu Wu,Weisheng Liu,Yu Tang Dalton Trans., 2013,42, 9840-9846
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Mengke Li,Xinyi Cai,Zhenyang Qiao,Wentao Xie,Liangying Wang,Nan Zheng,Shi-Jian Su Chem. Commun., 2019,55, 7215-7218
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Shivani Sharma,Chia-Ming Wu,Ranjit T. Koodali,N. Rajesh RSC Adv., 2016,6, 26668-26678
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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