3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-1-t-butyl acetate

Base Information

Chemical Name:3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-1-t-butyl acetate
CAS No.:98626-45-0
Molecular Formula:C16H22N2O3
Molecular Weight:290.362
Hs Code.:2933990090
DSSTox Substance ID:DTXSID70394908
Nikkaji Number:J1.821.386I
ChEMBL ID:CHEMBL295683
Mol file:98626-45-0.mol

Synonyms:98626-45-0;tert-butyl 2-(3-amino-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)acetate;3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-1-t-butyl acetate;tert-butyl 2-(3-amino-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetate;CHEMBL295683;MFCD03426719;115406-14-9;1H-1-Benzazepine-1-acetic acid, 3-amino-2,3,4,5-tetrahydro-2-oxo-, 1,1-dimethylethyl ester, (R)- (9CI);SCHEMBL5672901;DTXSID70394908;QTEDVVHLTMELTB-UHFFFAOYSA-N;BDBM50228281;MFCD02258988;AKOS007930202;CS-O-32318;SB30607;SY014475;SY269137;FT-0602887;F77313;tert-butyl 3-amino-2,3,4,5-tetrahydro-2-oxo-1h-1-benzazepine-1-acetate;tert-butyl 3-amino-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-1-acetate;(7S-Amino-6-oxo-6,7,8,9-tetrahydro-5H-benzocyclohepten-5-yl)-acetic acid tert-butyl ester;2,3,4,5-Tetrahydro-2-oxo-3-amino-1H-1-benzazepine-1-acetic acid tert-butyl ester;3-AMINO-2,3,4,5-TETRAHYDRO-2-OXO-1H-BENZAZEPINE-1-ACETIC ACID TERT-BUTYL ESTER;racemic tert-butyl 3-amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetate;tert-butyl (RS)-3-amino-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-1-acetate;tert-butyl 2-(3-amino-2-oxo-2,3,4,5-tetrahydrobenzo[b]azepin-1-yl)acetate

Suppliers and Price of 3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-1-t-butyl acetate

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

Biosynth Carbosynth
3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-aceticacid ter-butylester
1 g
$ 528.00

Biosynth Carbosynth
3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-aceticacid ter-butylester
500 mg
$ 305.00

Biosynth Carbosynth
3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-aceticacid ter-butylester
250 mg
$ 175.00

Biosynth Carbosynth
3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-aceticacid ter-butylester
100 mg
$ 88.00

Biosynth Carbosynth
3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-aceticacid ter-butylester
50 mg
$ 51.00

Total 10 raw suppliers

Chemical Property of 3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-1-t-butyl acetate

Chemical Property:

Melting Point:107-109 °C
Boiling Point:483.2 °C at 760 mmHg
PKA:7.37±0.20(Predicted)
Flash Point:246 °C
PSA：72.63000
Density:1.133 g/cm³
LogP:2.99350
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:290.16304257
Heavy Atom Count:21
Complexity:403

Purity/Quality:

98%Min ^*data from raw suppliers

3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-aceticacid ter-butylester ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)CN1C2=CC=CC=C2CCC(C1=O)N

Technology Process of 3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-1-t-butyl acetate

There total 1 articles about 3-Amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-1-t-butyl acetate 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:

: 86499-96-9
3-bromo-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one

: 98626-45-0
1-tert-butoxycarbonylmethyl-3S-amino-2,3,4,5-tetrahydro-1H-⁽¹⁾-benzazepin-2-one

Guidance literature:: Multi-step reaction with 3 steps

1: 83 percent / dimethylformamide / 16 h / 60 °C

2: 93 percent / kalium-(tert-butylat) / dimethylformamide / 1 h / 0 - 5 °C

3: 85 percent / 2-aminoethanol / 0.08 h / 80 °C

With potassium tert-butylate; ethanolamine; In N,N-dimethyl-formamide;
DOI:10.1002/hlca.19880710205