Cas no 827045-01-2 (Benzene, 1-(bromomethyl)-2,5-diiodo-4-methyl-)
827045-01-2 structure
Product Name:Benzene, 1-(bromomethyl)-2,5-diiodo-4-methyl-
CAS No:827045-01-2
MF:C8H7BrI2
MW:436.854126214981
CID:685738
PubChem ID:58083847
Update Time:2025-04-19
Benzene, 1-(bromomethyl)-2,5-diiodo-4-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-(bromomethyl)-2,5-diiodo-4-methyl-
- 1-(bromomethyl)-2,5-diiodo-4-methylbenzene
- DTXSID70728764
- CS-0088430
- 827045-01-2
- SCHEMBL10027400
-
- Inchi： 1S/C8H7BrI2/c1-5-2-8(11)6(4-9)3-7(5)10/h2-3H,4H2,1H3
- InChI Key： CIKRLMUAOORPSR-UHFFFAOYSA-N
- SMILES： IC1C=C(C)C(=CC=1CBr)I
Computed Properties
- Exact Mass: 435.78206g/mol
- Monoisotopic Mass: 435.78206g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 129
- 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: 4.1
- Topological Polar Surface Area: 0?2
Benzene, 1-(bromomethyl)-2,5-diiodo-4-methyl- Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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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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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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