Cas no 19991-05-0 (3-(2-bromoethyl)-1,2,4,5-tetramethylbenzene)
19991-05-0 structure
Product Name:3-(2-bromoethyl)-1,2,4,5-tetramethylbenzene
CAS No:19991-05-0
MF:C12H17Br
MW:241.167382955551
CID:908802
PubChem ID:53403908
Update Time:2025-04-19
3-(2-bromoethyl)-1,2,4,5-tetramethylbenzene Chemical and Physical Properties
Names and Identifiers
-
- 3-(2-bromoethyl)-1,2,4,5-tetramethylbenzene
- 19991-05-0
- DTXSID70695285
-
- MDL： MFCD11110054
- Inchi： 1S/C12H17Br/c1-8-7-9(2)11(4)12(5-6-13)10(8)3/h7H,5-6H2,1-4H3
- InChI Key： BWIHQEXLCPLRQN-UHFFFAOYSA-N
- SMILES： BrCCC1C(C)=C(C)C=C(C)C=1C
Computed Properties
- Exact Mass: 240.05136g/mol
- Monoisotopic Mass: 240.05136g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 141
- 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: 5.2
- Topological Polar Surface Area: 0?2
3-(2-bromoethyl)-1,2,4,5-tetramethylbenzene Related Literature
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1. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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