Diphenylmethyl (6R-trans)-3-methoxy-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate

Base Information

Chemical Name:Diphenylmethyl (6R-trans)-3-methoxy-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate
CAS No.:54639-52-0
Molecular Formula:C29H26 N2 O6 S
Molecular Weight:530.601
Hs Code.:
European Community (EC) Number:259-267-9
DSSTox Substance ID:DTXSID90969910
Nikkaji Number:J326.661C
Wikidata:Q82952977
Mol file:54639-52-0.mol

Synonyms:EINECS 259-267-9;54639-52-0;Diphenylmethyl (6R-trans)-3-methoxy-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate;Diphenylmethyl (6R-trans)-3-methoxy-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate;SCHEMBL10840214;C29H26N2O6S;DTXSID90969910;QLVVZQVGFLLLLB-UFHPHHKVSA-N;C29-H26-N2-O6-S;7beta-phenoxyacetamido-3-methoxy-ceph-3-em-4-carboxylic acid diphenylmethyl ester;(6R,7R)-3-Methoxy-8-oxo-7-[(phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid diphenylmethyl ester;N-{2-[(Diphenylmethoxy)carbonyl]-3-methoxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl}-2-phenoxyethanimidic acid

Suppliers and Price of Diphenylmethyl (6R-trans)-3-methoxy-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate

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

Total 3 raw suppliers

Chemical Property of Diphenylmethyl (6R-trans)-3-methoxy-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate

Chemical Property:

Vapor Pressure:2.26E-26mmHg at 25°C
Boiling Point:811.2°C at 760 mmHg
Flash Point:444.4°C
PSA：122.96000
Density:1.38g/cm³
LogP:4.43430
XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:530.15115773
Heavy Atom Count:38
Complexity:874

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=C(N2C(C(C2=O)NC(=O)COC3=CC=CC=C3)SC1)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5
Isomeric SMILES:COC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)COC3=CC=CC=C3)SC1)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

Technology Process of Diphenylmethyl (6R-trans)-3-methoxy-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate

There total 5 articles about Diphenylmethyl (6R-trans)-3-methoxy-8-oxo-7-(phenoxyacetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate 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:

: 54639-52-0
(6R)-3-methoxy-8-oxo-7t-(2-phenoxy-acetylamino)-(6rH)-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester

Guidance literature:: Diazomethan, entspr. 3-Hydroxy-cephem-derivat;

Reference yield:

: 54639-52-0
7β-Phenoxyacetylamino-3-methoxy-3-cephem-4-carbonsaeurebenzhydrylester

Guidance literature:: 3-Methylencephamverb., 1. O3, 2. Me2S, 3. 1-Methyl-3-p-tolyltriazen;

Reference yield:

: 40849-60-3
7-Phenoxyacetamido-3-exo-methylene cepham

: 54639-52-0
benzhydryl 3-methoxy-7β-(2-phenoxyacetamido)-Δ³-cephem-4-carboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: benzene

2: (i) O₂, O₃, CH₂Cl₂, (ii) Me₂S, (iii) /BRN= 102415/, Et₂O

In benzene;
DOI:10.1002/hlca.19740570705