N-(3-Aminopropyl)biotinamide trifluoroacetate

Base Information

Chemical Name:N-(3-Aminopropyl)biotinamide trifluoroacetate
CAS No.:244760-26-7
Molecular Formula:C₂HF₃O₂*C₁₃H₂₄N₄O₂S
Molecular Weight:414.449
Hs Code.:
DSSTox Substance ID:DTXSID50584941
Mol file:244760-26-7.mol

Synonyms:N-(3-Aminopropyl)biotinamide trifluoroacetate;244760-26-7;N-(+)-Biotinyl-3-aminopropylammonium trifluoroacetate;5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-(3-aminopropyl)pentanamide;2,2,2-trifluoroacetic acid;SCHEMBL13737599;DTXSID50584941;N-(+)-BIOTINYL-3-AMINOPROPYLAMMONIUM TRI;N-(+)-Biotinyl-3-aminopropylammonium trifluoroacetate, >=97.0% (HPLC);N-(3-aminopropyl)-5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamide 2,2,2-trifluoroacetate;Trifluoroacetic acid--N-(3-aminopropyl)-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide (1/1)

Suppliers and Price of N-(3-Aminopropyl)biotinamide trifluoroacetate

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

Sigma-Aldrich
N-(+)-Biotinyl-3-aminopropylammonium trifluoroacetate ≥97.0% (HPLC)
500mg-f
$ 349.00

Sigma-Aldrich
N-(+)-Biotinyl-3-aminopropylammonium trifluoroacetate ≥97.0% (HPLC)
100mg-f
$ 173.00

American Custom Chemicals Corporation
N-(+)-BIOTINYL-3-AMINOPROPYLAMMONIUM TRIFLUOROACETATE 95.00%
5MG
$ 500.81

Total 2 raw suppliers

Chemical Property of N-(3-Aminopropyl)biotinamide trifluoroacetate

Chemical Property:

PSA：165.83000
LogP:2.31990
Storage Temp.:2-8°C
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:414.15486095
Heavy Atom Count:27
Complexity:437

Purity/Quality:

98%,99%, ^*data from raw suppliers

N-(+)-Biotinyl-3-aminopropylammonium trifluoroacetate ≥97.0% (HPLC) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C2C(C(S1)CCCCC(=O)NCCCN)NC(=O)N2.C(=O)(C(F)(F)F)O
Isomeric SMILES:C1[C@H]2[C@@H]([C@@H](S1)CCCCC(=O)NCCCN)NC(=O)N2.C(=O)(C(F)(F)F)O

Technology Process of N-(3-Aminopropyl)biotinamide trifluoroacetate

There total 4 articles about N-(3-Aminopropyl)biotinamide trifluoroacetate 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: 100.0%

: tert-butyl (3-(5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanamido)propyl)carbamate

: 244760-26-7
N-(+)-biotinyl-3-aminopropylammonium trifluoroacetate

Guidance literature:: With trifluoroacetic acid; In dichloromethane; at 0 - 20 ℃; for 3h;
DOI:10.1248/cpb.c16-00501

Reference yield: 85.0%

: 76-05-1
trifluoroacetic acid

: 3-(tert-butyloxycarbonylamino)propyl-1-biotinylamide

: 244760-26-7
3-biotinylaminopropylammonium trifluoroacetate

Guidance literature:: In dichloromethane; at 20 ℃; for 2h;
DOI:10.1080/00397919908085937

Reference yield:

: 58-85-5,22879-79-4
biotin

: 244760-26-7
N-(+)-biotinyl-3-aminopropylammonium trifluoroacetate

Guidance literature:: Multi-step reaction with 2 steps

1.1: 1-hydroxy-pyrrolidine-2,5-dione; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / N,N-dimethyl-formamide / 6 h / 20 °C / Inert atmosphere

1.2: 21 h / 20 °C / Inert atmosphere

2.1: trifluoroacetic acid / dichloromethane / 3 h / 0 - 20 °C

With 1-hydroxy-pyrrolidine-2,5-dione; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; trifluoroacetic acid; In dichloromethane; N,N-dimethyl-formamide;
DOI:10.1248/cpb.c16-00501