Cas no 476155-84-7 ((5-Bromo-3-methylthiophen-2-yl)methanol)
476155-84-7 structure
Product Name:(5-Bromo-3-methylthiophen-2-yl)methanol
CAS No:476155-84-7
MF:C6H7BrOS
MW:207.088179826736
CID:2119601
Update Time:2023-08-03
(5-Bromo-3-methylthiophen-2-yl)methanol Chemical and Physical Properties
Names and Identifiers
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- (5-bromo-3-methylthiophen-2-yl)methanol
- PZFBIYZQVJDUFH-UHFFFAOYSA-N
- (5-bromo-3-methylthien-2-yl)methanol
- 2-Thiophenemethanol, 5-bromo-3-methyl-
- (5-Bromo-3-methylthiophen-2-yl)methanol
-
- Inchi： 1S/C6H7BrOS/c1-4-2-6(7)9-5(4)3-8/h2,8H,3H2,1H3
- InChI Key： PZFBIYZQVJDUFH-UHFFFAOYSA-N
- SMILES： BrC1=CC(C)=C(CO)S1
Computed Properties
- Exact Mass: 205.94
- Monoisotopic Mass: 205.94
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 99.1
- 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
- Topological Polar Surface Area: 48.5
(5-Bromo-3-methylthiophen-2-yl)methanol Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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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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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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