Decahydro-2-naphthyl acetate

Base Information

• Chemical Name: Decahydro-2-naphthyl acetate
• CAS No.: 10519-11-6
• Molecular Formula: C12H20O2
• Molecular Weight: 196.29
• European Community (EC) Number: 234-054-3
• NSC Number: 85888
• UNII: 1A258Z18EC
• DSSTox Substance ID: DTXSID4051534
• Nikkaji Number: J167.258D
• Mol file: 10519-11-6.mol

Synonyms:Decahydro-2-naphthyl acetate;10519-11-6;2-Decalinyl acetate;Decahydronaphthol acetate;Decahydro-beta-naphthyl acetate;DECAHYDRO-2-NAPHTHOL ACETATE;2-Naphthalenol, decahydro-, acetate;decahydronaphthalen-2-yl acetate;1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl acetate;2-NAPHTHOL, DECAHYDRO-, ACETATE;Decahydro-2-naphthalenol acetate;EINECS 234-054-3;NSC 85888;2-Naphthalenol, decahydro-, 2-acetate;Decahydro-.beta.-naphthyl acetate;1A258Z18EC;NSC-85888;NCIOpen2_000981;SCHEMBL113630;UNII-1A258Z18EC;DTXSID4051534;decahydro - 2 - naphthyl acetate;NSC85888;AKOS006242791;LS-95422;Acetic acid decahydronaphthalen-2-yl ester;FT-0624483;W-110275

Chemical Property of Decahydro-2-naphthyl acetate

Chemical Property:

• Vapor Pressure: 0.0196mmHg at 25°C
• Refractive Index: 1.48
• Boiling Point: 252.2 °C at 760 mmHg
• Flash Point: 104.3 °C
• PSA: 26.30000
• Density: 1g/cm³
• LogP: 2.90840
• Water Solubility.: 54mg/L at 20℃
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 196.146329876
• Heavy Atom Count: 14
• Complexity: 212

Purity/Quality:

98% ^*data from raw suppliers

DECAHYDRO-2-NAPHTHYL ACETATE Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC1CCC2CCCCC2C1

Technology Process of Decahydro-2-naphthyl acetate

There total 23 articles about Decahydro-2-naphthyl acetate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 98.0%

(2R*,4aS*,8aR*)-decahydro-2-naphthol (825-51-4,1424-36-8,1424-37-9,2529-06-8,5746-67-8,5746-69-0,5779-35-1,36667-73-9,52079-66-0,54324-61-7,84276-31-3,84276-32-4,88644-15-9,91684-34-3,91684-35-4,91684-37-6) + acetic anhydride (108-24-7) → (+/-)-cis,trans-decahydro-2-naphthyl acetate (10519-11-6,36667-74-0,36667-75-1,54289-24-6,54324-64-0,54656-99-4,66964-88-3,66964-89-4,91684-32-1,91684-33-2,92621-77-7,92621-78-8)

Guidance literature:

With pyridine;

Reference yield: 20.0%

(2R*,4aR*,8aS*)-decahydro-2-naphthyl tosylate (3275-10-3,19124-23-3,19124-24-4,40429-90-1,40429-92-3,54053-73-5) + sodium acetate (127-09-3) → (+/-)-cis,trans-decahydro-2-naphthyl acetate (10519-11-6,36667-74-0,36667-75-1,54289-24-6,54324-64-0,54656-99-4,66964-88-3,66964-89-4,91684-32-1,91684-33-2,92621-77-7,92621-78-8)

Guidance literature:

In acetic acid; at 50 ℃; for 15h;

Reference yield:

trans-Decalin (493-02-7) + acetic anhydride (108-24-7) → (+/-)-trans,cis-decahydro-2-naphthyl acetate (10519-11-6,36667-74-0,36667-75-1,54289-24-6,54324-64-0,54656-99-4,66964-88-3,66964-89-4,91684-32-1,91684-33-2,92621-77-7,92621-78-8) + trans-trans-2-decahydronaphthyl acetate (66964-89-4) + cis-9-decahydronaphthyl acetate (36144-10-2) + trans-decalin-2-one (4832-17-1,5779-29-3,5779-30-6,16021-08-2,52079-67-1,91684-29-6,91684-30-9,1579-21-1,143392-76-1)

Guidance literature:

With oxygen; Co-Ce-NH₄Br; at 100 ℃; for 0.5h; under 760 Torr; Yield given. Further byproducts given. Yields of byproduct given. Title compound not separated from byproducts;

DOI:10.1246/cl.1986.1409

upstream raw materials:

acetic anhydride

decahydronaphthalen-2-ol

acetic acid

β-naphthol

Downstream raw materials:

(2R*,4aS*,8aR*)-decahydro-2-naphthol

(2R,4aS,8aR)-decahydro-2-naphthol

(2S,4aR,8aS)-decahydro-2-naphthol