Damsin

Base Information

• Chemical Name: Damsin
• CAS No.: 1216-42-8
• Molecular Formula: C15H20 O3
• Molecular Weight: 248.322
• NSC Number: 85249
• DSSTox Substance ID: DTXSID70923878
• Nikkaji Number: J14.024D
• Wikidata: Q27106332
• ChEMBL ID: CHEMBL2286469
• Mol file: 1216-42-8.mol

Synonyms:damsin

Chemical Property of Damsin

Chemical Property:

• Vapor Pressure: 7.61E-07mmHg at 25°C
• Boiling Point: 407.3°Cat760mmHg
• Flash Point: 181.4°C
• PSA: 43.37000
• Density: 1.13g/cm³
• LogP: 2.49950
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 248.14124450
• Heavy Atom Count: 18
• Complexity: 439

Purity/Quality:

99%, ^*data from raw suppliers

DAMSIN 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCC2C(C3(C1CCC3=O)C)OC(=O)C2=C
• Isomeric SMILES: C[C@H]1CC[C@@H]2[C@H]([C@]3([C@H]1CCC3=O)C)OC(=O)C2=C

Technology Process of Damsin

There total 3 articles about Damsin 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:

→ (+/-)-2-epi-Damsin (1216-42-8,60133-11-1,63039-02-1,94163-23-2,125225-29-8)

Guidance literature:

Hydroxymethylverb. 22/22a (ca. 85/15 Epimerengemisch), 1. p-TsCl/Pyridin 2. Δ;

DOI:10.1021/jo00441a032

Reference yield:

→ damsin (1216-42-8)

Guidance literature:

Ambrosin, Pd-C, H2;

DOI:10.1007/BF00569828

Reference yield:

→ Dihydro-coronopilin (1216-42-8,60133-11-1,63039-02-1,94163-23-2,125225-29-8)

Guidance literature:

Coronopilin (II), Zn-Staub;

DOI:10.1007/BF00564151

Downstream raw materials:

ambrosin