5-[[[(Phenylmethoxy)carbonyl]amino]methyl]-1,3-benzenedicarboxylic acid

Base Information

Chemical Name:5-[[[(Phenylmethoxy)carbonyl]amino]methyl]-1,3-benzenedicarboxylic acid
CAS No.:323202-05-7
Molecular Formula:C17H15NO6
Molecular Weight:329.309
Hs Code.:
DSSTox Substance ID:DTXSID601151090

Synonyms:DTXSID601151090;5-[[[(Phenylmethoxy)carbonyl]amino]methyl]-1,3-benzenedicarboxylic acid;323202-05-7

Suppliers and Price of 5-[[[(Phenylmethoxy)carbonyl]amino]methyl]-1,3-benzenedicarboxylic acid

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 5-[[[(Phenylmethoxy)carbonyl]amino]methyl]-1,3-benzenedicarboxylic acid

Chemical Property:

XLogP3:2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:329.08993720
Heavy Atom Count:24
Complexity:438

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)COC(=O)NCC2=CC(=CC(=C2)C(=O)O)C(=O)O

Technology Process of 5-[[[(Phenylmethoxy)carbonyl]amino]methyl]-1,3-benzenedicarboxylic acid

There total 1 articles about 5-[[[(Phenylmethoxy)carbonyl]amino]methyl]-1,3-benzenedicarboxylic acid 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: 73.0%

: 23341-13-1
5-cyano-1,3-benzenedicarboxylic acid

: 501-53-1,94274-21-2
benzyl chloroformate

: 323202-05-7
5-[(benzyloxycarbonyl)aminomethyl]isophthalic acid

Guidance literature:: 5-cyano-1,3-benzenedicarboxylic acid; With hydrogenchloride; hydrogen; palladium on activated charcoal; In ethanol; for 24h;

benzyl chloroformate; With sodium hydroxide; In water; at 20 ℃; for 3h;
DOI:10.1002/1099-0690(200011)2000:22<3771::AID-EJOC3771>3.0.CO;2-1

Reference yield: 72.0%

: 323202-05-7
5-[(benzyloxycarbonyl)aminomethyl]isophthalic acid

: 323202-06-8
1,1'-{[(5-benzyloxycarbonylamino)methyl]-1,3-phenylene}bis(methanol)

Guidance literature:: With borane-THF; In tetrahydrofuran; at 0 - 20 ℃; for 6h;
DOI:10.1002/1099-0690(200011)2000:22<3771::AID-EJOC3771>3.0.CO;2-1

Reference yield: 63.0%

: 85916-13-8
tert-butyl iminodiacetate

: 323202-05-7
5-[(benzyloxycarbonyl)aminomethyl]isophthalic acid

: {[3-(benzyloxycarbonylamino-methyl)-5-(bis-tert-butoxycarbonylmethyl-carbamoyl)-benzoyl]-tert-butoxycarbonylmethyl-amino}-acetic acid tert-butyl ester

Guidance literature:: With 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; at 20 ℃; for 6h;
DOI:10.1021/ja0317731