Cas no 1260022-84-1 (3-Bromo-2-ethylphenol)
3-Bromo-2-ethylphenol structure
Product Name:3-Bromo-2-ethylphenol
CAS No:1260022-84-1
MF:C8H9BrO
MW:201.060461759567
CID:2113497
PubChem ID:18964087
Update Time:2024-03-01
3-Bromo-2-ethylphenol Chemical and Physical Properties
Names and Identifiers
-
- 3-bromo-2-ethylPhenol
- JGZOKGXRMVJYEO-UHFFFAOYSA-N
- MB23614
- 3-Bromo-2-ethylphenol
-
- Inchi： 1S/C8H9BrO/c1-2-6-7(9)4-3-5-8(6)10/h3-5,10H,2H2,1H3
- InChI Key： JGZOKGXRMVJYEO-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC(=C1CC)O
Computed Properties
- Exact Mass: 199.98368g/mol
- Monoisotopic Mass: 199.98368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 105
- 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: 20.2
3-Bromo-2-ethylphenol Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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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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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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