646483-08-1
646483-08-1 structure
- Name: 4-hydroxy-5-Methyl-5-octylthiophen-2(5H)-one
- Chemical Name: 5-hydroxy-2-methyl-2-octylthiophen-3-one
- CAS Number: 646483-08-1
- Molecular Formula: C13H22O2S
- Molecular Weight: 242.37800
- Create Date: 2016-10-31 17:45:55
- Modify Date: 2024-03-05 10:39:11
| Name | 5-hydroxy-2-methyl-2-octylthiophen-3-one |
|---|---|
| Synonyms |
2(5H)-Thiophenone,4-hydroxy-5-methyl-5-octyl
4-HYDROXY-5-METHYL-5-OCTYLTHIOPHEN-2(5H)-ONE 5-hydroxy-2-methyl-2-octyl-3-thiophenone (+/-)-4-hydroxy-5-methyl-5-octyl-5H-thiophen-2-one 2-methyl-2-octyl-5-oxidanyl-thiophen-3-one |
| Molecular Formula | C13H22O2S |
|---|---|
| Molecular Weight | 242.37800 |
| Exact Mass | 242.13400 |
| PSA | 62.60000 |
| LogP | 4.21100 |
|
~%
646483-08-1 |
| Literature: McFadden, Jill M.; Medghalchi, Susan M.; Thupari, Jagan N.; Pinn, Michael L.; Vadlamudi, Aravinda; Miller, Katherine I.; Kuhajda, Francis P.; Townsend, Craig A. Journal of Medicinal Chemistry, 2005 , vol. 48, # 4 p. 946 - 961 |
|
~%
646483-08-1 |
| Literature: McFadden, Jill M.; Medghalchi, Susan M.; Thupari, Jagan N.; Pinn, Michael L.; Vadlamudi, Aravinda; Miller, Katherine I.; Kuhajda, Francis P.; Townsend, Craig A. Journal of Medicinal Chemistry, 2005 , vol. 48, # 4 p. 946 - 961 |
|
~74%
646483-08-1 |
| Literature: FASGEN, INC.; THE JOHNS HOPKINS UNIVERSITY Patent: WO2004/5277 A1, 2004 ; Location in patent: Page 29 ; WO 2004/005277 A1 |
| Precursor 3 | |
|---|---|
| DownStream 1 | |
