Cas no 179894-11-2 (Benzene, 1-bromo-4-(decyloxy)-2-methyl-)
179894-11-2 structure
Product Name:Benzene, 1-bromo-4-(decyloxy)-2-methyl-
CAS No:179894-11-2
MF:C17H27BrO
MW:327.299684762955
CID:1369957
PubChem ID:71353347
Update Time:2025-04-20
Benzene, 1-bromo-4-(decyloxy)-2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-bromo-4-(decyloxy)-2-methyl-
- 1-bromo-4-decoxy-2-methylbenzene
- 179894-11-2
- DTXSID20778097
- AKOS021454676
- 1-BROMO-4-(DECYLOXY)-2-METHYLBENZENE
-
- Inchi： 1S/C17H27BrO/c1-3-4-5-6-7-8-9-10-13-19-16-11-12-17(18)15(2)14-16/h11-12,14H,3-10,13H2,1-2H3
- InChI Key： FLFSQUONXLZPSK-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=CC=1C)OCCCCCCCCCC
Computed Properties
- Exact Mass: 326.12461
- Monoisotopic Mass: 326.12453g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 19
- Rotatable Bond Count: 10
- Complexity: 207
- 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: 7.4
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23
Benzene, 1-bromo-4-(decyloxy)-2-methyl- Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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4. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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