Cas no 872619-45-9 (Benzene, 1-bromo-2,4-bis(chloromethyl)-)
872619-45-9 structure
Product Name:Benzene, 1-bromo-2,4-bis(chloromethyl)-
CAS No:872619-45-9
MF:C8H7BrCl2
MW:253.951179742813
CID:1869601
PubChem ID:11976667
Update Time:2025-04-21
Benzene, 1-bromo-2,4-bis(chloromethyl)- Chemical and Physical Properties
Names and Identifiers
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- Benzene, 1-bromo-2,4-bis(chloromethyl)-
- 1-bromo-2,4-bis(chloromethyl)benzene
- DTXSID301290841
- 872619-45-9
-
- Inchi： 1S/C8H7BrCl2/c9-8-2-1-6(4-10)3-7(8)5-11/h1-3H,4-5H2
- InChI Key： RNZIZIMIWSSAQM-UHFFFAOYSA-N
- SMILES： BrC1=CC=C(CCl)C=C1CCl
Computed Properties
- Exact Mass: 251.91082g/mol
- Monoisotopic Mass: 251.91082g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 119
- 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: 3.4
- Topological Polar Surface Area: 0?2
Benzene, 1-bromo-2,4-bis(chloromethyl)- Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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