Cas no 1261450-35-4 (3-Cyano-5-(difluoromethyl)toluene)
1261450-35-4 structure
Product Name:3-Cyano-5-(difluoromethyl)toluene
CAS No:1261450-35-4
MF:C9H7F2N
MW:167.155389070511
CID:4791420
Update Time:2025-07-31
3-Cyano-5-(difluoromethyl)toluene Chemical and Physical Properties
Names and Identifiers
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- 3-Cyano-5-(difluoromethyl)toluene
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- Inchi： 1S/C9H7F2N/c1-6-2-7(5-12)4-8(3-6)9(10)11/h2-4,9H,1H3
- InChI Key： MNJVPQRIBDCXPJ-UHFFFAOYSA-N
- SMILES： FC(C1C=C(C#N)C=C(C)C=1)F
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 194
- XLogP3: 2.6
- Topological Polar Surface Area: 23.8
3-Cyano-5-(difluoromethyl)toluene Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A013004912-1g |
3-Cyano-5-(difluoromethyl)toluene |
1261450-35-4 | 97% | 1g |
$1460.20 | 2023-09-03 |
3-Cyano-5-(difluoromethyl)toluene Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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N. Soin,D. Boyer,K. Prashanthi,S. Sharma,A. A. Narasimulu,J. Luo,T. H. Shah,E. Siores,T. Thundat Chem. Commun., 2015,51, 8257-8260
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