Cas no 125904-10-1 (Benzene,(2-bromoethyl)-, ar-bromo derivs.)
125904-10-1 structure
Product Name:Benzene,(2-bromoethyl)-, ar-bromo derivs.
CAS No:125904-10-1
MF:C8H7Br3
MW:342.853180170059
CID:176479
PubChem ID:22833423
Update Time:2025-04-19
Benzene,(2-bromoethyl)-, ar-bromo derivs. Chemical and Physical Properties
Names and Identifiers
-
- Benzene,(2-bromoethyl)-, ar-bromo derivs.
- 1,3-dibromo-5-(2-bromoethyl)benzene
- benzene, 1,3-dibromo-5-(2-bromoethyl)-
- DTXSID80880504
- 75894-88-1
- 4J4NM4TCT2
- 3,5-dibromophenethyl bromide
- UNII-4J4NM4TCT2
- 125904-10-1
-
- Inchi： 1S/C8H7Br3/c9-2-1-6-3-7(10)5-8(11)4-6/h3-5H,1-2H2
- InChI Key： XVYXVLJEOUQEDU-UHFFFAOYSA-N
- SMILES： BrCCC1C=C(C=C(C=1)Br)Br
Computed Properties
- Exact Mass: 339.80971
- Monoisotopic Mass: 339.81
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 106
- 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: 0A^2
- XLogP3: 4.3
Experimental Properties
- Density: 2.043
- Boiling Point: 323.8°C at 760 mmHg
- Flash Point: 146.4°C
- Refractive Index: 1.619
- PSA: 0
Benzene,(2-bromoethyl)-, ar-bromo derivs. Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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