Basic information
- CAS
468-68-8- Standard SMILES
CC1=CCC2C(C)(C)CCCC2(C)C1CO- InChIKey
HMWSKUKBAWWOJL-UHFFFAOYSA-N- Molecular formula
- C15H26O
- Average molar mass
- 222.37 g/mol
- Monoisotopic mass
- 222.19836545
Overview
1-Naphthalenemethanol, 1,4,4a,5,6,7,8,8a-octahydro-2,5,5,8a-tetramethyl- has been reported in Persicaria hydropiper with data available.
Names & identifiers
- Preferred name
- (2,5,5,8a-Tetramethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methanol
- IUPAC
- (2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methanol
- English name
- (-)-Drimenol
- Molecular formula
- C15H26O
- Molecular weight
- 222.37
Names & synonyms
(2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methanolDTXSID20963668RefChem:1049626DTXCID401391408(2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methanol1-Naphthalenemethanol, 1,4,4a,5,6,7,8,8a-octahydro-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-Octahydro-2,5,5,8a-tetramethyl-1-naphthalenemethanol19078-37-6(?)-DrimenolDrimenol, (-)-SCHEMBL6511122HMWSKUKBAWWOJL-UHFFFAOYSA-N
Show more names
(-)-Drimenol(-)-Drimenol(A')-Drimenol(-)-Drimenol, 99+%((1S,4aS,8aS)-2,5,5,8a-Tetramethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methanol1-Naphthalenemethanol, 1,4,4a,5,6,7,8,8a-octahydro-2,5,5,8a-tetramethyl-, (1S,4aS,8aS)-
NSC169775NSC-169775AG-690/12868925(2,5,5,8a-Tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenyl)methanol(2,5,5,8a-Tetramethyl-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenyl)methanol #1-Naphthalenemethanol,4,4a,5,6,7,8,8a-octahydro-2,5,5,8a-tetramethyl-, [1S-(1.alpha.,4a.beta.,8a.alpha.)]-1-Naphthalenemethanol,4,4a.alpha.,5,6,7,8,8a-octahydro-2,5,5,8a.beta.-tetramethyl-, (-)-
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 303
Physicochemical properties
- Melting point
- 98 °C · 98 °C
- Boiling point
- 298.8 · 298.8±9.0 °C(Predicted)
- Density
- 0.921 · 0.921±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- DMF: Soluble; DMSO: Soluble; Ethanol: Soluble; Methanol: Soluble
- form
- A solid
- pka
- 14.82 · 14.82±0.10(Predicted)
- LogP
- 4.742 · 4.742 (est)
Chemistry & industry
Applications
UsesDrimenol is a drimane-type sesquiterpene that can be isolated from Valerian plant[1].
Upstream & downstream products
Downstream products
Suppliers36 total
陕西科贝莱药物研发有限公司13119135307 13119135307 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
成都普睿法药物研发有限公司82633860 18982077548 · [email protected]
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
Aladdin Scientific[email protected]
孟成科技（上海）有限公司400-820-6829 · [email protected]
成都普思生物科技股份有限公司028-85370565-229 18080489829 · [email protected]
上海维亦特生物科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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