Cas no 916420-56-9 (3-METHYL-5-(TRIFLUOROMETHOXY)PHENYLACETONITRILE)
3-Methyl-5-(trifluoromethoxy)phenylacetonitrile is a fluorinated aromatic nitrile compound characterized by its trifluoromethoxy and methyl substituents on the phenyl ring. This structure imparts unique electronic and steric properties, making it a valuable intermediate in organic synthesis, particularly in the development of pharmaceuticals, agrochemicals, and specialty materials. The trifluoromethoxy group enhances lipophilicity and metabolic stability, while the nitrile functionality offers versatile reactivity for further derivatization. Its well-defined purity and consistent performance make it suitable for precision applications in research and industrial processes. The compound is typically handled under standard laboratory conditions, with attention to stability and compatibility in synthetic workflows.
916420-56-9 structure
Product Name:3-METHYL-5-(TRIFLUOROMETHOXY)PHENYLACETONITRILE
CAS No:916420-56-9
MF:C10H8F3NO
MW:215.17183303833
MDL:MFCD09025374
CID:4664983
PubChem ID:46737541
Update Time:2025-10-08
3-METHYL-5-(TRIFLUOROMETHOXY)PHENYLACETONITRILE Chemical and Physical Properties
Names and Identifiers
-
- 3-METHYL-5-(TRIFLUOROMETHOXY)PHENYLACETONITRILE
- JS-4608
- SCHEMBL25786877
- 2-[3-methyl-5-(trifluoromethoxy)phenyl]acetonitrile
- AKOS015956823
- 916420-56-9
- DTXSID401239614
- 3-Methyl-5-(trifluoromethoxy)benzeneacetonitrile
- 2-(3-Methyl-5-(trifluoromethoxy)phenyl)acetonitrile
- MFCD09025374
-
- MDL： MFCD09025374
- Inchi： 1S/C10H8F3NO/c1-7-4-8(2-3-14)6-9(5-7)15-10(11,12)13/h4-6H,2H2,1H3
- InChI Key： QVUHRNMOVVDGKT-UHFFFAOYSA-N
- SMILES： FC(OC1C=C(C)C=C(CC#N)C=1)(F)F
Computed Properties
- Exact Mass: 215.05579836g/mol
- Monoisotopic Mass: 215.05579836g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 255
- 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: 3.1
- Topological Polar Surface Area: 33?2
3-METHYL-5-(TRIFLUOROMETHOXY)PHENYLACETONITRILE Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | M106860-250mg |
3-Methyl-5-(trifluoromethoxy)phenylacetonitrile |
916420-56-9 | 250mg |
$ 370.00 | 2022-06-04 | ||
| TRC | M106860-500mg |
3-Methyl-5-(trifluoromethoxy)phenylacetonitrile |
916420-56-9 | 500mg |
$ 610.00 | 2022-06-04 | ||
| abcr | AB264463-1 g |
3-Methyl-5-(trifluoromethoxy)phenylacetonitrile, 97%; . |
916420-56-9 | 97% | 1g |
€330.10 | 2023-04-26 | |
| Apollo Scientific | PC302965-1g |
3-Methyl-5-(trifluoromethoxy)phenylacetonitrile |
916420-56-9 | 98% | 1g |
￡163.00 | 2025-02-21 | |
| abcr | AB264463-1g |
3-Methyl-5-(trifluoromethoxy)phenylacetonitrile, 97%; . |
916420-56-9 | 97% | 1g |
€329.50 | 2025-04-15 | |
| SHANG HAI BI DE YI YAO KE JI GU FEN Co., Ltd. | BD320395-1g |
2-(3-Methyl-5-(trifluoromethoxy)phenyl)acetonitrile |
916420-56-9 | 95+% | 1g |
￥1698.0 | 2024-04-17 | |
| Ambeed | A484246-1g |
2-(3-Methyl-5-(trifluoromethoxy)phenyl)acetonitrile |
916420-56-9 | 95% | 1g |
$400.0 | 2025-04-15 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1532553-1g |
2-(3-Methyl-5-(trifluoromethoxy)phenyl)acetonitrile |
916420-56-9 | 98% | 1g |
￥2646.00 | 2024-04-25 | |
| 1PlusChem | 1P00GYNC-1g |
3-METHYL-5-(TRIFLUOROMETHOXY)PHENYLACETONITRILE |
916420-56-9 | 1g |
$270.00 | 2024-04-20 | ||
| A2B Chem LLC | AH90600-1g |
2-(3-Methyl-5-(trifluoromethoxy)phenyl)acetonitrile |
916420-56-9 | 1g |
$273.00 | 2024-07-18 |
3-METHYL-5-(TRIFLUOROMETHOXY)PHENYLACETONITRILE Related Literature
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
-
P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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