Metalol

Base Information

Chemical Name:Metalol
CAS No.:7701-65-7
Molecular Formula:C₁₁H₁₈N₂O₃S
Molecular Weight:258.342
Hs Code.:
DSSTox Substance ID:DTXSID00998296
Nikkaji Number:J8.963J
ChEMBL ID:CHEMBL2110946
Mol file:7701-65-7.mol

Synonyms:METALOL;7701-65-7;N-[4-[1-hydroxy-2-(methylamino)propyl]phenyl]methanesulfonamide;4'-(1-Hydroxy-2-(methylamino)propyl)methanesulfonanilide;MJ-1998,(+/-);N-{4-[1-HYDROXY-2-(METHYLAMINO)PROPYL]PHENYL}METHANESULFONAMIDE;SCHEMBL613921;CHEMBL2110946;BDBM81451;DTXSID00998296;PDSP1_000162;PDSP2_000161;CAS_120852;NSC_120852;Methanesulfonamide, N-(4-(1-hydroxy-2-(methylamino)phenyl)phenyl)-

Suppliers and Price of Metalol

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
METALOL 95.00%
5MG
$ 499.38

Total 1 raw suppliers

Chemical Property of Metalol

Chemical Property:

Vapor Pressure:2.86E-08mmHg at 25°C
Boiling Point:433.1°Cat760mmHg
PKA:8.33±0.10(Predicted)
Flash Point:215.7°C
PSA：86.81000
Density:1.271g/cm³
LogP:2.24410
XLogP3:-0.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:258.10381361
Heavy Atom Count:17
Complexity:318

Purity/Quality:

99% ^*data from raw suppliers

METALOL 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C(C1=CC=C(C=C1)NS(=O)(=O)C)O)NC
Uses Anti-adrenergic (β-receptor).

Technology Process of Metalol

There total 6 articles about Metalol 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:

: 5322-38-3
4'-(α-Benzylmethyl-aminopropionyl)-methansulfonanilid

: 7701-65-7
N-[4-((1S,2R)-1-Hydroxy-2-methylamino-propyl)-phenyl]-methanesulfonamide

Guidance literature:: With hydrogen; palladium on activated charcoal; In methanol;
DOI:10.1021/jm00319a023

Reference yield:

: 1197-22-4
N-phenylmethanesulfonamide

: 7701-65-7
N-[4-((1S,2R)-1-Hydroxy-2-methylamino-propyl)-phenyl]-methanesulfonamide

Guidance literature:: Multi-step reaction with 3 steps

1: AlCl₃ / CS₂

2: acetonitrile

3: H₂ / Pd-C / methanol

With aluminium trichloride; hydrogen; palladium on activated charcoal; In methanol; carbon disulfide; acetonitrile;
DOI:10.1021/jm00319a023

Reference yield:

: 5317-90-8
N-<4-(2-bromo-1-oxopropyl)phenyl>methanesulfonamide

: 7701-65-7
N-[4-((1S,2R)-1-Hydroxy-2-methylamino-propyl)-phenyl]-methanesulfonamide

Guidance literature:: Multi-step reaction with 2 steps

1: acetonitrile

2: H₂ / Pd-C / methanol

With hydrogen; palladium on activated charcoal; In methanol; acetonitrile;
DOI:10.1021/jm00319a023