Benzyl 2-amino-2-iminoethylcarbamate

Base Information

• Chemical Name: Benzyl 2-amino-2-iminoethylcarbamate
• CAS No.: 77390-81-9
• Molecular Formula: C10H13N3O2
• Molecular Weight: 207.232
• NSC Number: 54760
• DSSTox Substance ID: DTXSID50998605
• Wikidata: Q82991264

Synonyms:77390-81-9;BENZYL 2-AMINO-2-IMINOETHYLCARBAMATE;Benzyl N-(carbamimidoylmethyl)carbamate;NSC54760;benzyl (2-amino-2-iminoethyl)carbamate;SCHEMBL3254019;DTXSID50998605;BNVPWJZNPNLYJI-UHFFFAOYSA-N;AMY17025;NSC-54760;BenzylN-(carbamimidoylmethyl)carbamate;AB71993;FT-0703636;carbamimidoylmethyl-carbamic acid benzyl ester;EN300-118366;Benzyl hydrogen (2-amino-2-iminoethyl)carbonimidate

Chemical Property of Benzyl 2-amino-2-iminoethylcarbamate

Chemical Property:

• Density: 1.23g/cm³
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 207.100776666
• Heavy Atom Count: 15
• Complexity: 225

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC(=O)NCC(=N)N

Technology Process of Benzyl 2-amino-2-iminoethylcarbamate

There total 6 articles about Benzyl 2-amino-2-iminoethylcarbamate 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:

ethyl 2-benzyloxycarbonylaminoacetimidate hydrochloride (51030-44-5) → 2-<(phenylmethoxy)carbonyl>aminoacetamidine (77390-81-9)

Guidance literature:

With ammonia; In ethanol;

DOI:10.1246/bcsj.46.3277

Reference yield:

benzyl chloroformate (501-53-1,94274-21-2) → 2-<(phenylmethoxy)carbonyl>aminoacetamidine (77390-81-9)

Guidance literature:

Multi-step reaction with 2 steps

1: aq. NaOH

2: NH₃ / ethanol

With sodium hydroxide; ammonia; In ethanol;

DOI:10.1248/cpb.16.2355

Reference yield:

3,5-O-isopropylidene-2'-N-benzyloxycarbonylaminomethyl-α-D-xylofuranoso<1,2-d>-Δ2'-oxazoline (77390-70-6) → 2-<(phenylmethoxy)carbonyl>aminoacetamidine (77390-81-9)

Guidance literature:

With ammonia; In methanol; for 6h;

DOI:10.1039/P19810000657

upstream raw materials:

ethyl 2-phenylmethoxycarbonylaminoethanimidate

2-benzyloxycarbonylamino-acetimidic acid cyclohexyl ester

3,5-O-isopropylidene-2'-N-benzyloxycarbonylaminomethyl-α-D-xylofuranoso<1,2-d>-Δ^2'-oxazoline

ethyl 2-benzyloxycarbonylaminoacetimidate hydrochloride

Downstream raw materials:

7-[2-(Benzyloxycarbonylamino-methyl)-pyrimidin-4-yl]-1-ethyl-6-fluoro-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid

benzyl [(4-oxo-4,5,7,8-tetrahydro-3H-pyrano[4,3-d]pyrimidin-2-yl)methyl]carbamate

{2-[(3-chloro-pyrazine-2-carbonyl)-amino]-2-imino-ethyl}-carbamic acid benzyl ester

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