2-[4-methyl-3-(trifluoromethyl)phenyl]acetonitrile
Structure Info
- Chemspace ID
- CSSB00000061559 (In-Stock Building Blocks)
- CAS
- 1000526-63-5
- MFCD
- MFCD09832291, MFCD09832291
- IUPAC Name
- 2-[4-methyl-3-(trifluoromethyl)phenyl]acetonitrile
- Mol formula
- C10H8F3N
- Mol weight
- 199 Da
- Catalog Number(s)
- 117126, AA0091FU, AE21670, AG0091IM, AG155461, AGN-PC-0WAOIF, AGNPC-0WAOIF, AR00927M, ArZ-UP471396, BBV-38270726, BD306926, CD12188720, CS-0439574, CSC000061559, EN300-2007254, FCH834970, H59240, IMED3227124616, JS-4584, LN00218423, M106795, OFC1000526635, PC302609, SAB-040352, ST0092ZE, TX0092OA, Y3405978, Y4335122, ZX-NM290346
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.06
- Heavy atoms count
- 14
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.3
- Polar surface area (Å)
- 24
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
![Chemical structure of 2-[4-methyl-3-(trifluoromethyl)phenyl]acetonitrile (C10H8F3N) - CSSB00000061559](/st/structure/200/66ef7312da565b41c241fb2182c8a508/CC1%253DCC%253DC%2528CC%2523N%2529C%253DC1C%2528F%2529%2528F%2529F.png "C10H8F3N")
- Zoom the structure
- CSSB00000061559
Items Overall 50 items from 11 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific CN | 3 days | China To: | 98 | 250 mg | 94.60 | |
| 1st Scientific CN | 3 days | China To: | 98 | 1 g | 198.00 | |
| 1st Scientific CN | 3 days | China To: | 98 | 5 g | 602.80 | |
| 1st Scientific CN | 3 days | China To: | 98 | 10 g | 1,038.40 | |
| 1st Scientific CN | 3 days | China To: | 98 | 25 g | 2,057.00 | |
Description: 4-Methyl-3-(trifluoromethyl)phenylacetonitrile; CAS: 1000526-63-5 | ||||||
| 1st Scientific LLC | 3 days | United States To: | 98 | 250 mg | 94.60 | |
| 1st Scientific LLC | 3 days | United States To: | 98 | 1 g | 198.00 | |
| 1st Scientific LLC | 3 days | United States To: | 98 | 5 g | 602.80 | |
| 1st Scientific LLC | 3 days | United States To: | 98 | 10 g | 1,038.40 | |
| 1st Scientific LLC | 3 days | United States To: | 98 | 25 g | 2,057.00 | |
Description: 4-Methyl-3-(trifluoromethyl)phenylacetonitrile; CAS: 1000526-63-5 | ||||||
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 26.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 36.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 53.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 91.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 142.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 277.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 5 g | 410.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 10 g | 608.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 26.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 36.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 53.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 91.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 1 g | 142.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 2.5 g | 277.00 | |
| Apollo Scientific | 10 days | United Kingdom To: | 90 | 1 g | 172.00 | |
| Apollo Scientific | 10 days | United Kingdom To: | 90 | 5 g | 685.00 | |
| Apollo Scientific | 10 days | United Kingdom To: | 90 | 10 g | 1,231.00 | |
Description: CAS: 1000526-63-5 | ||||||
| Apollo Scientific USA | 10 days | United States To: | 90 | 1 g | 172.00 | |
| Apollo Scientific USA | 10 days | United States To: | 90 | 5 g | 685.00 | |
| Apollo Scientific USA | 10 days | United States To: | 90 | 10 g | 1,231.00 | |
Description: CAS: 1000526-63-5 | ||||||
| Key Organics Limited (BIONET) | 10 days | United Kingdom To: | 97 | 1 g | 243.10 | |
| A2B Chem | 12 days | United States To: | 98 | 250 mg | 77.05 | |
| A2B Chem | 12 days | United States To: | 98 | 1 g | 186.30 | |
| A2B Chem | 12 days | United States To: | 98 | 5 g | 654.35 | |
| A2B Chem | 12 days | United States To: | 98 | 10 g | 1,138.50 | |
| A2B Chem | 12 days | United States To: | 98 | 25 g | 2,270.10 | |
Description: 4-Methyl-3-(trifluoromethyl)phenylacetonitrile; CAS: 1000526-63-5 | ||||||
| AA BLOCKS | 12 days | United States To: | 98 | 250 mg | 90.20 | |
| AA BLOCKS | 12 days | United States To: | 98 | 1 g | 205.70 | |
| AA BLOCKS | 12 days | United States To: | 98 | 5 g | 660.00 | |
| AA BLOCKS | 12 days | United States To: | 98 | 10 g | 1,149.50 | |
Description: 4-Methyl-3-(trifluoromethyl)phenylacetonitrile; CAS: 1000526-63-5 | ||||||
| eNovation CN | 20 days | China To: | 95 | 250 mg | 115.00 | |
| eNovation CN | 20 days | China To: | 95 | 1 g | 224.25 | |
| eNovation CN | 20 days | China To: | 95 | 5 g | 690.00 | |
| eNovation CN | 20 days | China To: | 95 | 10 g | 1,207.50 | |
| eNovation CN | 20 days | China To: | 95 | 25 g | 2,415.00 | |
Description: 4-Methyl-3-(trifluoromethyl)phenylacetonitrile; CAS: 1000526-63-5 | ||||||
| 10X CHEM | TBD | United States To: | 98 | 250 mg | 66.00 | |
| 10X CHEM | TBD | United States To: | 98 | 1 g | 159.50 | |
| 10X CHEM | TBD | United States To: | 98 | 5 g | 528.00 | |
| 10X CHEM | TBD | United States To: | 98 | 10 g | 924.00 | |
| 10X CHEM | TBD | United States To: | 98 | 25 g | 1,849.10 | |
Description: 4-Methyl-3-(trifluoromethyl)phenylacetonitrile; CAS: 1000526-63-5 | ||||||
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Substructure Analogs
![Chemical structure of 2-[2-fluoro-4-methyl-3-(trifluoromethyl)phenyl]acetonitrile - CSSB00011084150](/st/structure/200/21db2388de5f827df6c83b5aff1dbfdb/CC1%253DCC%253DC%2528CC%2523N%2529C%2528F%2529%253DC1C%2528F%2529%2528F%2529F.png)
![Chemical structure of 2-[3-bromo-4-methyl-5-(trifluoromethyl)phenyl]acetonitrile - CSSB00135252600](/st/structure/200/9485cf4100a0048254e5185038ddd064/CC1%253DC%2528Br%2529C%253DC%2528CC%2523N%2529C%253DC1C%2528F%2529%2528F%2529F.png)
Similarity Analogs
![Chemical structure of 2-[3-methyl-4-(trifluoromethyl)phenyl]acetonitrile - CSSB00009842607](/st/structure/200/34b88bb0cd290f47e28d488c648c0152/CC1%253DCC%2528CC%2523N%2529%253DCC%253DC1C%2528F%2529%2528F%2529F.png)
![Chemical structure of 2-[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]acetonitrile - CSSB00011012268](/st/structure/200/3b70dec5da4771fa8497c1ace51bda49/COC1%253DC%2528C%2529C%253DC%2528CC%2523N%2529C%253DC1C%2528F%2529%2528F%2529F.png)
![Chemical structure of 2-[4-iodo-3-(trifluoromethyl)phenyl]acetonitrile - CSSB00010150518](/st/structure/200/29000b4ddb186216ec09608be8ee49ce/FC%2528F%2529%2528F%2529C1%253DCC%2528CC%2523N%2529%253DCC%253DC1I.png)
![Chemical structure of 2-[4-bromo-3-(trifluoromethyl)phenyl]acetonitrile - CSSB00010254841](/st/structure/200/b9fc98a127c7a1ea65fc9921995d8d1f/FC%2528F%2529%2528F%2529C1%253DCC%2528CC%2523N%2529%253DCC%253DC1Br.png)
![Chemical structure of 2-[4-fluoro-3-methyl-5-(trifluoromethyl)phenyl]acetonitrile - CSSB00010381658](/st/structure/200/f9bfc90841129819401ffd73e16eae49/CC1%253DCC%2528CC%2523N%2529%253DCC%2528%253DC1F%2529C%2528F%2529%2528F%2529F.png)
