(4-(Aminomethyl)-3-methylphenyl)(2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)methanone

Base Information

Chemical Name:(4-(Aminomethyl)-3-methylphenyl)(2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)methanone
CAS No.:736127-06-3
Molecular Formula:C19H22N2O
Molecular Weight:294.396
Hs Code.:
DSSTox Substance ID:DTXSID201130848

Synonyms:736127-06-3;(4-(Aminomethyl)-3-methylphenyl)(2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)methanone;(4-Aminomethyl-3-methylphenyl)-(2,3,4,5-tetrahydrobenzo[b]azepin-1-yl)methanone;SCHEMBL1346004;SKCOMCAQFPNEHZ-UHFFFAOYSA-N;DTXSID201130848;BS-46234;CS-0159430;E74567;(4-(aminomethyl)-3-methylphenyl)(2,3,4,5-tetrahydrobenzo[b]azepin-1-yl)methanone;[4-(Aminomethyl)-3-methylphenyl](2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)methanone;[4-(aminomethyl)-3-methylphenyl]-(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methanone;1-[2-methyl-4-(2,3,4,5-tetrahydro-1H-1-benzazepine-1-carbonyl)phenyl]methanamine

Suppliers and Price of (4-(Aminomethyl)-3-methylphenyl)(2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)methanone

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 2 raw suppliers

Chemical Property of (4-(Aminomethyl)-3-methylphenyl)(2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)methanone

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:294.173213330
Heavy Atom Count:22
Complexity:384

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=C(C=CC(=C1)C(=O)N2CCCCC3=CC=CC=C32)CN

Technology Process of (4-(Aminomethyl)-3-methylphenyl)(2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)methanone

There total 1 articles about (4-(Aminomethyl)-3-methylphenyl)(2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)methanone 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: 89.0%

: 335155-20-9
1-(4-Cyano-3-methylbenzoyl)-2,3,4,5-tetrahydro-1H-1-benzazepine

: 736127-06-3
1-[2-methyl-4-(2,3,4,5-tetrahydro-1H-1-benzazepin-1-ylcarbonyl)-phenyl]methanamine

Guidance literature:: 1-(4-Cyano-3-methylbenzoyl)-2,3,4,5-tetrahydro-1H-1-benzazepine; With sodium tetrahydroborate; cobalt(II) chloride hexahydrate; In methanol; at 0 - 20 ℃; Inert atmosphere;

With potassium hydrogensulfate; In methanol; water;
DOI:10.1021/jm901084f

Reference yield: 95.0%

: 736127-06-3
1-[2-methyl-4-(2,3,4,5-tetrahydro-1H-1-benzazepin-1-ylcarbonyl)-phenyl]methanamine

: 530-62-1
1,1'-carbonyldiimidazole

: 479234-57-6
(S)-(4-methyl-1,4-diazepan-1-yl)(pyrrolidin-2-yl)methanethione

: 1209963-25-6
(2S)-N-[2-methyl-4-(2,3,4,5-tetrahydro-1H-1-benzazepin-1-ylcarbonyl)benzyl]-2-[(4-methyl-1,4-diazepan-1-yl)carbonothioyl]-pyrrolidine-1-carboxamide

Guidance literature:: 1-[2-methyl-4-(2,3,4,5-tetrahydro-1H-1-benzazepin-1-ylcarbonyl)-phenyl]methanamine; 1,1'-carbonyldiimidazole; With N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃; for 1h; Inert atmosphere;

(S)-(4-methyl-1,4-diazepan-1-yl)(pyrrolidin-2-yl)methanethione; With N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃;
DOI:10.1021/jm901084f

Reference yield:

: 736127-06-3
1-[2-methyl-4-(2,3,4,5-tetrahydro-1H-1-benzazepin-1-ylcarbonyl)-phenyl]methanamine

: 530-62-1
1,1'-carbonyldiimidazole

: C₂₃H₂₄N₄O₂

Guidance literature:: With N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃; for 0.666667h; Inert atmosphere;
DOI:10.1021/jm8008162