Cas no 920036-40-4 (Phenol, 4-chloro-3-fluoro-5-methoxy-)
920036-40-4 structure
Product Name:Phenol, 4-chloro-3-fluoro-5-methoxy-
CAS No:920036-40-4
MF:C7H6ClFO2
MW:176.572744846344
CID:759063
PubChem ID:44550968
Update Time:2025-04-19
Phenol, 4-chloro-3-fluoro-5-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 4-chloro-3-fluoro-5-methoxy-
- 4-chloro-3-fluoro-5-methoxyphenol
- XXGVLIVLLCHFLZ-UHFFFAOYSA-N
- 920036-40-4
- SCHEMBL3155200
- DTXSID30659308
-
- Inchi: 1S/C7H6ClFO2/c1-11-6-3-4(10)2-5(9)7(6)8/h2-3,10H,1H3
- InChI Key: XXGVLIVLLCHFLZ-UHFFFAOYSA-N
- SMILES: ClC1=C(C=C(C=C1OC)O)F
Computed Properties
- Exact Mass: 176.0040353g/mol
- Monoisotopic Mass: 176.0040353g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 134
- 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: 2.3
- Topological Polar Surface Area: 29.5?2
Phenol, 4-chloro-3-fluoro-5-methoxy- Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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