Primeverin

Base Information

• Chemical Name: Primeverin
• CAS No.: 154-60-9
• Molecular Formula: C₂₀H₂₈O₁₃
• Molecular Weight: 476.435
• European Community (EC) Number: 690-850-4
• DSSTox Substance ID: DTXSID40165506
• Nikkaji Number: J2.304.898A
• Wikidata: Q72502152
• Mol file: 154-60-9.mol

Synonyms:Primeverin;154-60-9;methyl 4-methoxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxybenzoate;Benzoic acid, 4-methoxy-2-((6-O-beta-D-xylopyranosyl-beta-D-glucopyranosyl)oxy)-, methyl ester;Primverin, HPLC Grade;DTXSID40165506;C20H28O13;AKOS040735711;NCGC00385068-02;NCGC00385068-02_C20H28O13_Benzoic acid, 4-methoxy-2-[(6-O-beta-D-xylopyranosyl-beta-D-glucopyranosyl)oxy]-, methyl ester

Chemical Property of Primeverin

Chemical Property:

• Vapor Pressure: 1.91E-23mmHg at 25°C
• Melting Point: 206℃
• Boiling Point: 747.1°Cat760mmHg
• Flash Point: 259°C
• PSA: 193.83000
• Density: 1.56g/cm³
• LogP: -2.87620
• Storage Temp.: 2-8°C
• XLogP3: -2.5
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 8
• Exact Mass: 476.15299094
• Heavy Atom Count: 33
• Complexity: 635

Purity/Quality:

98%Min ^*data from raw suppliers

Primeverin phyproof? Reference Substance ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=C(C=C1)C(=O)OC)OC2C(C(C(C(O2)COC3C(C(C(CO3)O)O)O)O)O)O
• Isomeric SMILES: COC1=CC(=C(C=C1)C(=O)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO[C@H]3[C@@H]([C@H]([C@@H](CO3)O)O)O)O)O)O

Technology Process of Primeverin

There total 1 articles about Primeverin 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:

→ primeverin (154-60-9)

Guidance literature:

With methanol; ammonia;

DOI:10.1039/jr9330001618