(1S,2R,5R)-5-(4-Chloro-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol

Base Information

Chemical Name:(1S,2R,5R)-5-(4-Chloro-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol
CAS No.:105522-08-5
Molecular Formula:C12H12ClN3O3
Molecular Weight:281.69498
Hs Code.:
DSSTox Substance ID:DTXSID20566618
Wikidata:Q82452310
Mol file:105522-08-5.mol

Synonyms:105522-08-5;(1S,2R,5R)-5-(4-Chloro-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol;(1S,2R,5R)-5-(4-chloroimidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol;SCHEMBL4306750;DTXSID20566618;AKOS016004880

Suppliers and Price of (1S,2R,5R)-5-(4-Chloro-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol

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

Crysdot
(1S,2R,5R)-5-(4-Chloro-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol 95+%
1g
$ 1067.00

Chemenu
(1S,2R,5R)-5-(4-chloro-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol 95%
1g
$ 1006.00

American Custom Chemicals Corporation
(1S,2R,5R)-5-(4-CHLORO-1H-IMIDAZO[4,5-C]PYRIDIN-1-YL)-3-(HYDROXYMETHYL)CYCLOPENT-3-ENE-1,2-DIOL 95.00%
1G
$ 2130.45

American Custom Chemicals Corporation
(1S,2R,5R)-5-(4-CHLORO-1H-IMIDAZO[4,5-C]PYRIDIN-1-YL)-3-(HYDROXYMETHYL)CYCLOPENT-3-ENE-1,2-DIOL 95.00%
5MG
$ 496.46

Alichem
(1S,2R,5R)-5-(4-Chloro-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol
1g
$ 950.40

Total 6 raw suppliers

Chemical Property of (1S,2R,5R)-5-(4-Chloro-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol

Chemical Property:

Boiling Point:583.2±60.0 °C(Predicted)
PKA:13.49±0.70(Predicted)
PSA：91.40000
Density:1.74±0.1 g/cm3(Predicted)
LogP:0.27990
Storage Temp.:2-8°C
XLogP3:-0.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:281.0567189
Heavy Atom Count:19
Complexity:381

Purity/Quality:

97% ^*data from raw suppliers

(1S,2R,5R)-5-(4-Chloro-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CN=C(C2=C1N(C=N2)C3C=C(C(C3O)O)CO)Cl
Isomeric SMILES:C1=CN=C(C2=C1N(C=N2)[C@@H]3C=C([C@H]([C@H]3O)O)CO)Cl

Technology Process of (1S,2R,5R)-5-(4-Chloro-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol

There total 5 articles about (1S,2R,5R)-5-(4-Chloro-1H-imidazo[4,5-c]pyridin-1-yl)-3-(hydroxymethyl)cyclopent-3-ene-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: 92.0%

: 877651-81-5
1-[(1R,4R,5S)-3-(trityloxymethyl)-4,5-O-iso-propylidinene-2-cyclopenten-1-yl]-4-chloroimidazo[4,5-c]pyridine

: 105522-08-5
(-)-1-<(1R,4R,5S)-3-(Hydroxymethyl)-4,5-dihydroxy-2-cyclopenten-1-yl>-4-chloroimidazo<4,5-c>pyridine

Guidance literature:: With hydrogenchloride; In methanol; at 0 - 20 ℃; for 260 - 360h;

Reference yield: 69.0%

: 105522-07-4
(-)-1-<(1R,4R,5S)-3-(Benzyloxymethyl)-4,5-O-isopropylidene-2-cyclopenten-1-yl>-4-chloroimidazo<4,5-c>pyridine

: 105522-08-5
(-)-1-<(1R,4R,5S)-3-(Hydroxymethyl)-4,5-dihydroxy-2-cyclopenten-1-yl>-4-chloroimidazo<4,5-c>pyridine

Guidance literature:: With boron trichloride; In dichloromethane; at -75 ℃; for 3.5h;
DOI:10.1021/jm00127a007

Reference yield:

: 89291-77-0
(1S,4R,5S)-(-)-3-<(benzyloxy)methyl>-4,5-O-isopropylidene-2-cyclopenten-1-ol methanesulfonate

: 105522-08-5
(-)-1-<(1R,4R,5S)-3-(Hydroxymethyl)-4,5-dihydroxy-2-cyclopenten-1-yl>-4-chloroimidazo<4,5-c>pyridine

Guidance literature:: Multi-step reaction with 2 steps

1: 1) NaH / 1) MeCN, r.t., 16 h, 2) reflux, 6 h

2: 69 percent / BCl₃ / CH₂Cl₂ / 3.5 h / -75 °C

With boron trichloride; sodium hydride; In dichloromethane;
DOI:10.1021/jm00127a007