2-Chloro-adenosine monophosphate

Base Information

Chemical Name:2-Chloro-adenosine monophosphate
CAS No.:21466-01-3
Molecular Formula:C₁₀H₁₃ClN₅O₇P
Molecular Weight:381.669
Hs Code.:
Nikkaji Number:J1.572.339D
ChEMBL ID:CHEMBL3244493
Mol file:21466-01-3.mol

Synonyms:2-chloro-adenosine monophosphate;2-chloro-AMP

Suppliers and Price of 2-Chloro-adenosine monophosphate

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

Medical Isotopes, Inc.
2-Chloroadenosine 5??-Monophosphate Ditriethylamine Salt
100 mg
$ 2400.00

Medical Isotopes, Inc.
2-Chloroadenosine5??-MonophosphateDitriethylamineSalt
10 mg
$ 675.00

Biosynth Carbosynth
2-Chloroadenosine 5'-monophosphate triethylamine salt
10 mg
$ 472.50

Biosynth Carbosynth
2-Chloroadenosine 5'-monophosphate triethylamine salt
5 mg
$ 262.50

Biosynth Carbosynth
2-Chloroadenosine 5'-monophosphate triethylamine salt
2 mg
$ 117.60

Total 8 raw suppliers

Chemical Property of 2-Chloro-adenosine monophosphate

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Boiling Point:765.331°C at 760 mmHg
Flash Point:416.657°C
PSA：187.24000
Density:2.401g/cm³
LogP:-0.13200
Storage Temp.:-20°C Freezer, Under Inert Atmosphere
Solubility.:Methanol; Water
XLogP3:-2.6
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:4
Exact Mass:381.0241125
Heavy Atom Count:24
Complexity:514

Purity/Quality:

98%Min ^*data from raw suppliers

2-Chloroadenosine 5??-Monophosphate Ditriethylamine Salt ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=NC2=C(N=C(N=C2N1C3C(C(C(O3)COP(=O)(O)O)O)O)Cl)N
Isomeric SMILES:C1=NC2=C(N=C(N=C2N1[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)Cl)N
Uses 2-Chloro-5''-adenylic Acid is an intermediate for the synthesis of 2-Chloroadenosine Triphosphate Ammonium Salt (C364109). 2-Chloroadenosine Triphosphate is a P2Y purinoceptor agonist. A metabolite of 2-Chloroadenosine; an adenine nucleotide receptor.

Technology Process of 2-Chloro-adenosine monophosphate

There total 5 articles about 2-Chloro-adenosine monophosphate 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: 37.0%

: pentasodium 5-phosphoribosyl-α-1-pyrophosphate

: 1839-18-5
2-chloroadenine

: 21466-01-3
phosphoric acid mono[(2R,3R,4S,5R)-5-(6-amino-2-chloro-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-ylmethyl]ester

Guidance literature:: With potassium dihydrogenphosphate; magnesium(II) chloride hexahydrate; recombinant Thermus thermophilus HB₂₇ adenine phosphoribosyltransferase; potassium hydroxide; In water; at 75 ℃; for 48h; pH=8; Temperature; Catalytic behavior; Enzymatic reaction;
DOI:10.3762/bjoc.14.289

Reference yield:

: Phosphoric acid (3aR,4R,6R,6aR)-6-(6-amino-2-chloro-purin-9-yl)-2,2-dimethyl-tetrahydro-furo[3,4-d][1,3]dioxol-4-ylmethyl ester di-tert-butyl ester

: 21466-01-3
phosphoric acid mono[(2R,3R,4S,5R)-5-(6-amino-2-chloro-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-ylmethyl]ester

Guidance literature:: With DOWEX 50WX₈-200; In methanol; water;
DOI:10.1021/jm010538v

Reference yield:

: 24639-06-3
((3aR,4R,6R,6aR)-6-(6-amino-2-chloro-9H-purin-9-yl)-2,2-dimethyltetrahydrofuro[3,4-d][1,3]dioxol-4-yl)methanol

: 21466-01-3
phosphoric acid mono[(2R,3R,4S,5R)-5-(6-amino-2-chloro-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-ylmethyl]ester

Guidance literature:: Multi-step reaction with 3 steps

1: tetrazole / tetrahydrofuran

2: m-CPBA / tetrahydrofuran; CH₂Cl₂

3: DOWEX 50Wx₈-200 / H₂O; methanol

With 1H-tetrazole; DOWEX 50WX₈-200; 3-chloro-benzenecarboperoxoic acid; In tetrahydrofuran; methanol; dichloromethane; water;
DOI:10.1021/jm010538v