Cas no 55231-61-3 (Benzene, 2,4-bis(bromomethyl)-1,3,5-trimethyl-)
55231-61-3 structure
Product Name:Benzene, 2,4-bis(bromomethyl)-1,3,5-trimethyl-
CAS No:55231-61-3
MF:C11H14Br2
MW:306.036861896515
CID:352478
PubChem ID:4386720
Update Time:2025-04-19
Benzene, 2,4-bis(bromomethyl)-1,3,5-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 2,4-bis(bromomethyl)-1,3,5-trimethyl-
- 2,4-bis(bromomethyl)-1,3,5-trimethylbenzene
- WCSDNXZKHJSIMH-UHFFFAOYSA-N
- 1,3-bis(bromomethyl)-2,4,6-trimethylbenzene
- DTXSID80402725
- 55231-61-3
- AKOS024330592
- SCHEMBL3255153
-
- Inchi： 1S/C11H14Br2/c1-7-4-8(2)11(6-13)9(3)10(7)5-12/h4H,5-6H2,1-3H3
- InChI Key： WCSDNXZKHJSIMH-UHFFFAOYSA-N
- SMILES： BrCC1C(C)=CC(C)=C(CBr)C=1C
Computed Properties
- Exact Mass: 303.94622
- Monoisotopic Mass: 303.94623g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 142
- 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
Experimental Properties
- PSA: 0
Benzene, 2,4-bis(bromomethyl)-1,3,5-trimethyl- Related Literature
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
-
Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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