Cas no 1806323-03-4 (Methyl 3-cyano-5-nitro-2-(trifluoromethyl)benzoate)
1806323-03-4 structure
Product Name:Methyl 3-cyano-5-nitro-2-(trifluoromethyl)benzoate
CAS No:1806323-03-4
MF:C10H5F3N2O4
MW:274.152912855148
CID:4795727
Update Time:2025-07-31
Methyl 3-cyano-5-nitro-2-(trifluoromethyl)benzoate Chemical and Physical Properties
Names and Identifiers
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- Methyl 3-cyano-5-nitro-2-(trifluoromethyl)benzoate
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- Inchi： 1S/C10H5F3N2O4/c1-19-9(16)7-3-6(15(17)18)2-5(4-14)8(7)10(11,12)13/h2-3H,1H3
- InChI Key： SXYSGYKBSCBXIA-UHFFFAOYSA-N
- SMILES： FC(C1C(C#N)=CC(=CC=1C(=O)OC)[N+](=O)[O-])(F)F
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 423
- XLogP3: 2.2
- Topological Polar Surface Area: 95.9
Methyl 3-cyano-5-nitro-2-(trifluoromethyl)benzoate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A015013201-250mg |
Methyl 3-cyano-5-nitro-2-(trifluoromethyl)benzoate |
1806323-03-4 | 97% | 250mg |
494.40 USD | 2021-05-31 | |
| Alichem | A015013201-500mg |
Methyl 3-cyano-5-nitro-2-(trifluoromethyl)benzoate |
1806323-03-4 | 97% | 500mg |
782.40 USD | 2021-05-31 | |
| Alichem | A015013201-1g |
Methyl 3-cyano-5-nitro-2-(trifluoromethyl)benzoate |
1806323-03-4 | 97% | 1g |
1,475.10 USD | 2021-05-31 |
Methyl 3-cyano-5-nitro-2-(trifluoromethyl)benzoate Related Literature
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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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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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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