1-(5-tert-butyl-2-methylphenyl)propan-1-one
Structure Info
- Chemspace ID
- CSSB00000043858 (In-Stock Building Blocks)
- MFCD
- MFCD14529920
- IUPAC Name
- 1-(5-tert-butyl-2-methylphenyl)propan-1-one
- Mol formula
- C14H20O
- Mol weight
- 204 Da
- Catalog Number(s)
- 383242, A383242, AA02JWIT, AR02JXAL, BBLS00000043858, BBV-45065162, BQ87745, CSC000043858, FCH1680163, H73098, OR1094300, ST02JY2D, TX02JXR9, bbls00000043858
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.29
- Heavy atoms count
- 15
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 17
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSB00000043858
Items Overall 20 items from 6 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific LLC | 7 days | United States To: | 95 | 250 mg | 386.10 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 500 mg | 533.50 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 1 g | 732.60 | |
Description: 1-[5-(1,1-Dimethylethyl)-2-methylphenyl]-1-propanone; CAS: 857391-50-5 | ||||||
| AOBChem USA | 12 days | United States To: | 95 | 250 mg | 319.00 | |
| AOBChem USA | 12 days | United States To: | 95 | 500 mg | 455.40 | |
| AOBChem USA | 12 days | United States To: | 95 | 1 g | 638.00 | |
Description: 1-[5-(1,1-Dimethylethyl)-2-methylphenyl]-1-propanone; CAS: 857391-50-5 | ||||||
| A2B Chem | 12 days | United States To: | 95 | 250 mg | 353.05 | |
| A2B Chem | 12 days | United States To: | 95 | 500 mg | 502.55 | |
| A2B Chem | 12 days | United States To: | 95 | 1 g | 704.95 | |
Description: 1-[5-(1,1-Dimethylethyl)-2-methylphenyl]-1-propanone; CAS: 857391-50-5 | ||||||
| AA BLOCKS | 12 days | United States To: | 95 | 250 mg | 355.30 | |
| AA BLOCKS | 12 days | United States To: | 95 | 500 mg | 506.00 | |
| AA BLOCKS | 12 days | United States To: | 95 | 1 g | 709.50 | |
Description: 1-[5-(1,1-Dimethylethyl)-2-methylphenyl]-1-propanone; CAS: 857391-50-5 | ||||||
| BB4LS GS | 15 days | Germany To: | 95 | 50 umol | 286.55 | |
| BB4LS GS | 15 days | Germany To: | 95 | 100 umol | 291.85 | |
| BB4LS GS | 15 days | Germany To: | 95 | 200 umol | 297.16 | |
| BB4LS GS | 15 days | Germany To: | 95 | 300 umol | 302.46 | |
| BB4LS GS | 15 days | Germany To: | 95 | 500 umol | 307.77 | |
| 10X CHEM | TBD | United States To: | 95 | 250 mg | 294.80 | |
| 10X CHEM | TBD | United States To: | 95 | 500 mg | 420.20 | |
| 10X CHEM | TBD | United States To: | 95 | 1 g | 588.50 | |
Description: 1-[5-(1,1-Dimethylethyl)-2-methylphenyl]-1-propanone; CAS: 857391-50-5 | ||||||
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Substructure Analogs
![Chemical structure of 1,6,6-trimethyl-1H,2H,6H,7H,8H,9H,10H,11H-phenanthro[1,2-b]furan-10,11-dione - CSSB00020668868](/st/structure/200/6c644c6d05e8b62d957d2ba97ca6fa5c/CC1COC2%253DC1C%2528%253DO%2529C%2528%253DO%2529C1%253DC3CCCC%2528C%2529%2528C%2529C3%253DCC%253DC21.png)
![Chemical structure of (1R)-1,6,6-trimethyl-1H,2H,6H,7H,8H,9H,10H,11H-phenanthro[1,2-b]furan-10,11-dione - CSSB00016987643](/st/structure/200/007d05977bf25fecf65338c99512d79c/C%255BC%2540H%255D1COC2%253DC1C%2528%253DO%2529C%2528%253DO%2529C1%253DC3CCCC%2528C%2529%2528C%2529C3%253DCC%253DC21.png)
![Chemical structure of 1,6,6-trimethyl-6H,7H,8H,9H,10H,11H-phenanthro[1,2-b]furan-10,11-dione - CSSB00016998379](/st/structure/200/7fc9ac39851d2fb742f9fd95aba9a769/CC1%253DCOC2%253DC1C%2528%253DO%2529C%2528%253DO%2529C1%253DC3CCCC%2528C%2529%2528C%2529C3%253DCC%253DC21.png)
![Chemical structure of 1,6,6-trimethyl-1H,2H,3aH,6H,7H,8H,9H,10H,11H,11aH-phenanthro[1,2-b]furan-10,11-dione - CSSB20621673528](/st/structure/200/9e948e31a70e5b347787f635014f5133/CC1COC2C1C%2528%253DO%2529C%2528%253DO%2529C1%253DC3CCCC%2528C%2529%2528C%2529C3%253DCC%253DC21.png)
Similarity Analogs
![Chemical structure of 1-[2-methyl-5-(trifluoromethyl)phenyl]propan-1-one - CSSB00024473217](/st/structure/200/820bb02c6738825dedb9cb16ac17085b/CCC%2528%253DO%2529C1%253DCC%2528%253DCC%253DC1C%2529C%2528F%2529%2528F%2529F.png)
