Cas no 55027-78-6 (3,5-dibromo-4-methoxyphenylacetonitrile)
55027-78-6 structure
Product Name:3,5-dibromo-4-methoxyphenylacetonitrile
CAS No:55027-78-6
MF:C9H7Br2NO
MW:304.965980768204
CID:2060568
Update Time:2025-04-21
3,5-dibromo-4-methoxyphenylacetonitrile Chemical and Physical Properties
Names and Identifiers
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- 3,5-dibromo-4-methoxyphenylacetonitrile
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- Inchi： 1S/C9H7Br2NO/c1-13-9-7(10)4-6(2-3-12)5-8(9)11/h4-5H,2H2,1H3
- InChI Key： YVNXQVCAENBGFU-UHFFFAOYSA-N
- SMILES： COC1C(Br)=CC(CC#N)=CC=1Br
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- XLogP3: 2.055
3,5-dibromo-4-methoxyphenylacetonitrile Related Literature
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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