Cas no 87767-94-0 (2-Bromophenethyl alcohol, acetate)
87767-94-0 structure
Product Name:2-Bromophenethyl alcohol, acetate
CAS No:87767-94-0
MF:C10H11BrO2
MW:243.097142457962
CID:652494
Update Time:2023-08-03
2-Bromophenethyl alcohol, acetate Chemical and Physical Properties
Names and Identifiers
-
- Benzeneethanol, b-bromo-, acetate
- 2-bromophenethyl acetate
- KENNXPUAPLLICU-UHFFFAOYSA-N
- 2-Bromophenethyl alcohol, acetate
-
- Inchi： 1S/C10H11BrO2/c1-8(12)13-7-6-9-4-2-3-5-10(9)11/h2-5H,6-7H2,1H3
- InChI Key： KENNXPUAPLLICU-UHFFFAOYSA-N
- SMILES： BrC1C=CC=CC=1CCOC(C)=O
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 170
- Topological Polar Surface Area: 26.3
2-Bromophenethyl alcohol, acetate Related Literature
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
-
Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
-
Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
-
Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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