(+-)-trans-Acenaphthene-1,2-diol

Base Information

• Chemical Name: (+-)-trans-Acenaphthene-1,2-diol
• CAS No.: 2963-87-3
• Molecular Formula: C12H10 O2
• Molecular Weight: 186.21
• DSSTox Substance ID: DTXSID30183810
• Nikkaji Number: J2.747.125K
• Wikidata: Q27103673
• Metabolomics Workbench ID: 51704
• Mol file: 2963-87-3.mol

Synonyms:2963-87-3;(+-)-trans-acenaphthene-1,2-diol;(1R,2R)-1,2-dihydroacenaphthylene-1,2-diol;trans-1,2-Acenaphthylene glycol;1,2-Acenaphthylenediol, 1,2-dihydro-, trans-;trans-1,2-dihydro-1,2-acenaphthylenediol;rel-(1R,2R)-1,2-dihydroacenaphthylene-1,2-diol;SCHEMBL638575;1,2-Acenaphthenediol, trans-;trans-1,2-dihydroxyacenaphthene;CHEBI:28395;DTXSID30183810;(1R)-Acenaphthene-1beta,2alpha-diol;AKOS006278973;AE-562/12222219;Q27103673

Chemical Property of (+-)-trans-Acenaphthene-1,2-diol

Chemical Property:

• Vapor Pressure: 2.23E-07mmHg at 25°C
• Boiling Point: 407.7°C at 760 mmHg
• Flash Point: 208°C
• Density: 1.444g/cm³
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 186.068079557
• Heavy Atom Count: 14
• Complexity: 206

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C3C(=C1)C(C(C3=CC=C2)O)O
• Isomeric SMILES: C1=CC2=C3C(=C1)[C@H]([C@@H](C3=CC=C2)O)O

Technology Process of (+-)-trans-Acenaphthene-1,2-diol

There total 10 articles about (+-)-trans-Acenaphthene-1,2-diol 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: 74.0%

acenaphthene quinone (82-86-0) → cis-acenaphthene-1,2-diol + trans-(1S,2S)-acenaphthene-1,2-diol (2963-86-2,2963-87-3,17976-92-0,95846-94-9,97590-27-7,139629-11-1)

Guidance literature:

With Sucrose; In water; dimethyl sulfoxide; at 30 ℃; for 48h; optical yield given as %ee; enantioselective reaction; Microbiological reaction;

DOI:10.1016/j.tetasy.2010.04.048

Reference yield: 65.0%

acenaphthene quinone (82-86-0) → trans-(1S,2S)-acenaphthene-1,2-diol (2963-86-2,2963-87-3,17976-92-0,95846-94-9,97590-27-7,139629-11-1)

Guidance literature:

With sodium tetrahydroborate; In methanol; at 0 - 20 ℃;

DOI:10.1002/ejoc.201100396

Reference yield: 5.0%

acenaphthene quinone (82-86-0) → cis-acenaphthene-1,2-diol + trans-(1S,2S)-acenaphthene-1,2-diol (2963-86-2,2963-87-3,17976-92-0,95846-94-9,97590-27-7,139629-11-1) + trans-(1R,2R)-acenaphthene-1,2-diol (97590-27-7)

Guidance literature:

With Sucrose; In water; at 30 ℃; for 48h; optical yield given as %ee; enantioselective reaction; Microbiological reaction;

DOI:10.1016/j.tetasy.2010.04.048

upstream raw materials:

acenaphthene quinone

cis-acenaphthene-1,2-diol

acenaphthene

Downstream raw materials:

cis-acenaphthene-1,2-diol

1(2H)-acenaphthylenone

fluoranthene

8,9-dimethylfluoranthene