Cefcapene pivoxil hydrochloride

Base Information

• Chemical Name: Cefcapene pivoxil hydrochloride
• CAS No.: 147816-24-8
• Molecular Formula: C₉H₁₃NO₂*ClH
• Molecular Weight: 203.669
• Hs Code.: 2941905990
• UNII: V16A6AYI9H
• Wikidata: Q27291405
• NCI Thesaurus Code: C98219
• ChEMBL ID: CHEMBL4303585
• Mol file: 147816-24-8.mol

Synonyms:cefcapene pivoxil hydrochloride

Chemical Property of Cefcapene pivoxil hydrochloride

Chemical Property:

• Appearance/Colour: off-white solid
• Vapor Pressure: 3.51E-32mmHg at 25°C
• Melting Point: 158-164 °C
• Boiling Point: 888.4 °C at 760 mmHg
• Flash Point: 491.1 °C
• PSA: 256.01000
• Density: 1.47 g/cm3
• LogP: 3.70600
• Storage Temp.: 0-10°C
• Solubility.: DMSO (Slightly), Methanol (Slightly), Water (Sparingly)
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 13
• Exact Mass: 621.1329977
• Heavy Atom Count: 40
• Complexity: 1060

Purity/Quality:

99% ^*data from raw suppliers

Cefcapene Pivoxil Hydrochloride Monohydrate >98.0%(HPLC)(N) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC=C(C1=CSC(=N1)N)C(=O)NC2C3N(C2=O)C(=C(CS3)COC(=O)N)C(=O)OCOC(=O)C(C)(C)C.O.Cl
• Isomeric SMILES: CC/C=C(/C1=CSC(=N1)N)\C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)COC(=O)N)C(=O)OCOC(=O)C(C)(C)C.O.Cl
• Recent NIPH Clinical Trials: A Phase III study of Solithromycin in patients with sinusitis

Technology Process of Cefcapene pivoxil hydrochloride

There total 10 articles about Cefcapene pivoxil hydrochloride 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: 82.0%

4-hydroxy-3-methoxyphenylacetonitrile (4468-59-1) → 3-Methoxytyramine hydrochloride (1477-68-5)

Guidance literature:

With hydrogenchloride; hydrogen; palladium on activated charcoal; In ethanol; at 20 ℃; for 12h;

DOI:10.1016/j.bmcl.2005.05.033

Reference yield: 81.0%

vanillalnitromethane (6178-42-3) → 3-Methoxytyramine hydrochloride (1477-68-5)

Guidance literature:

With hydrogenchloride; hydrogen; palladium on activated charcoal; In ethanol; at 0 ℃; under 760 Torr;

DOI:10.1246/bcsj.63.1252

Reference yield: 76.0%

3-methoxy-4-benzyloxy-ω-nitrostyrolene (63909-38-6,1860-56-6) → 3-Methoxytyramine hydrochloride (1477-68-5)

Guidance literature:

With hydrogenchloride; hydrogen; iron(III) chloride; platinum; In water; for 4h;

upstream raw materials:

3-methoxy-4-benzyloxy-ω-nitrostyrolene

4-hydroxy-3-methoxyphenylacetonitrile

vanillalnitromethane

3-methoxy-4-(phenylmethoxy)benzaldehyde

Refernces

• 1、 -. "Tetrahydropalmatine derivative and application thereof". . . Retrieved 2016/10/08.
• 2、 -. "TETRAHYDROPROTOBERBINE COMPOUNDS AND USES THEREOF IN THE TREATMENT OF NEUROLOGICAL, PSYCHIATRIC AND NEURODEGENERATIVE DISEASES". Paragraph 0193. . Retrieved 2013/03/26.