[(1R,2R)-1-hydroxy-1,2-dihydronaphthalen-2-yl] benzoate

Base Information

Chemical Name:[(1R,2R)-1-hydroxy-1,2-dihydronaphthalen-2-yl] benzoate
CAS No.:337376-51-9
Molecular Formula:C₁₇H₁₄O₃
Molecular Weight:266.296
Hs Code.:
DSSTox Substance ID:DTXSID90432311
Nikkaji Number:J1.984.156A
Wikidata:Q82246386
Mol file:337376-51-9.mol

Synonyms:337376-51-9;[(1R,2R)-1-hydroxy-1,2-dihydronaphthalen-2-yl] benzoate;SCHEMBL4854293;DTXSID90432311;(1R)-2alpha-(Benzoyloxy)-1,2-dihydronaphthalene-1beta-ol;(1R,2R)-trans-1-Hydroxy-1,2-dihydro-2-naphthyl benzoate, >=96%

Suppliers and Price of [(1R,2R)-1-hydroxy-1,2-dihydronaphthalen-2-yl] benzoate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
(1R,2R)-TRANS-1-HYDROXY-1,2-DIHYDRO-2-NAPHTHYL BENZOATE 95.00%
1G
$ 1593.90

American Custom Chemicals Corporation
(1R,2R)-TRANS-1-HYDROXY-1,2-DIHYDRO-2-NAPHTHYL BENZOATE 95.00%
100MG
$ 704.55

Total 1 raw suppliers

Chemical Property of [(1R,2R)-1-hydroxy-1,2-dihydronaphthalen-2-yl] benzoate

Chemical Property:

Boiling Point:448.2±45.0 °C(Predicted)
PKA:13.17±0.40(Predicted)
PSA：46.53000
Density:1.27±0.1 g/cm3(Predicted)
LogP:2.97240
Storage Temp.:2-8°C
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:266.094294304
Heavy Atom Count:20
Complexity:370

Purity/Quality:: (1R,2R)-TRANS-1-HYDROXY-1,2-DIHYDRO-2-NAPHTHYL BENZOATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C(=O)OC2C=CC3=CC=CC=C3C2O
Isomeric SMILES:C1=CC=C(C=C1)C(=O)O[C@@H]2C=CC3=CC=CC=C3[C@H]2O

Technology Process of [(1R,2R)-1-hydroxy-1,2-dihydronaphthalen-2-yl] benzoate

There total 6 articles about [(1R,2R)-1-hydroxy-1,2-dihydronaphthalen-2-yl] benzoate 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: 95.0%

: 573-57-9
1,4-epoxy-1,4-dihydronaphthalene

: 65-85-0,8013-63-6
benzoic acid

: 337376-51-9,359820-45-4
(1S,2S)-benzoic acid 1-hydroxy-1,2-dihydronaphthalen-2-yl-ester

Guidance literature:: 1,4-epoxy-1,4-dihydronaphthalene; With chloro(1,5-cyclooctadiene)rhodium(I) dimer; (2S,4S)-2,4-bis(diphenylphosphino)pentane; triethylamine; zinc(II) iodide; In 1,2-dichloro-ethane; for 0.166667h; Inert atmosphere; Schlenk technique;

benzoic acid; In 1,2-dichloro-ethane; at 40 ℃; for 1.5h; Reagent/catalyst; Time; enantioselective reaction; Inert atmosphere; Schlenk technique;
DOI:10.1016/j.tetasy.2016.11.004

Reference yield: 70.0%

: 337376-51-9,359820-45-4
(1R,2R)-benzoic acid 1-hydroxy-1,2-dihydro-naphthalen-2-yl-ester

: (1S,2S)-2-(4-cyanophenoxy)-1,2-dihydro-naphthalen-1-ol

Guidance literature:

Reference yield:

: 573-57-9
1,4-epoxy-1,4-dihydronaphthalene

: 65-85-0,8013-63-6
benzoic acid

: 337376-51-9,359820-45-4
(1S,2S)-benzoic acid 1-hydroxy-1,2-dihydronaphthalen-2-yl-ester

: 337376-51-9,359820-45-4
(1R,2R)-benzoic acid 1-hydroxy-1,2-dihydronaphthalen-2-yl-ester

Guidance literature:: With tol-BINAP; bis(1,5-cyclooctadiene)diiridium(I) dichloride; silver trifluoromethanesulfonate; tetra-(n-butyl)ammonium iodide; triethylamine; at 80 ℃; for 24h; Overall yield = 65 %; Overall yield = 34.6 mg; enantioselective reaction; Inert atmosphere;
DOI:10.1007/s10562-013-1136-x