1H-1,4-Diazepine-6-methanol, hexahydro-1-methyl-4-(phenylmethyl)-

Base Information

Chemical Name:1H-1,4-Diazepine-6-methanol, hexahydro-1-methyl-4-(phenylmethyl)-
CAS No.:138625-85-1
Molecular Formula:C14H22N2O
Molecular Weight:234.341
Hs Code.:
DSSTox Substance ID:DTXSID10443126

Synonyms:138625-85-1;1H-1,4-Diazepine-6-methanol, hexahydro-1-methyl-4-(phenylmethyl)-;DTXSID10443126

Suppliers and Price of 1H-1,4-Diazepine-6-methanol, hexahydro-1-methyl-4-(phenylmethyl)-

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
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price

Total 1 raw suppliers

Chemical Property of 1H-1,4-Diazepine-6-methanol, hexahydro-1-methyl-4-(phenylmethyl)-

Chemical Property:

XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:234.173213330
Heavy Atom Count:17
Complexity:216

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CN1CCN(CC(C1)CO)CC2=CC=CC=C2

Technology Process of 1H-1,4-Diazepine-6-methanol, hexahydro-1-methyl-4-(phenylmethyl)-

There total 3 articles about 1H-1,4-Diazepine-6-methanol, hexahydro-1-methyl-4-(phenylmethyl)- 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: 66.0%

: 138625-84-0
methyl 1-benzyl-4-methylhexahydro-1H-1,4-diazepine-6-carboxylate

: 138625-85-1
(1-benzyl-4-methylhexahydro-1H-1,4-diazepin-6-yl)methanol

Guidance literature:: With sodium bis(2-methoxyethoxy)aluminium dihydride; In toluene; a) 5 deg C, 0.5 h, b) RT, 12 h;
DOI:10.1248/cpb.43.1912

Reference yield:

: 56904-09-7
N-methyl-2-(benzylamino)ethylamine

: 138625-85-1
(1-benzyl-4-methylhexahydro-1H-1,4-diazepin-6-yl)methanol

Guidance literature:: Multi-step reaction with 3 steps

1: 1.) CH₃CN, RT, 20 min, 2.) CH₃CN, H₂O, RT, 20 h

2: 85 percent / thionyl chloride / 3 h / Ambient temperature

3: 66 percent / sodium bis(2-methoxyethoxy)aluminum hydride / toluene / a) 5 deg C, 0.5 h, b) RT, 12 h

With thionyl chloride; sodium bis(2-methoxyethoxy)aluminium dihydride; In toluene;
DOI:10.1248/cpb.43.1912

Reference yield:

: 166047-27-4
1-benzyl-4-methylhexahydro-1H-1,4-diazepine-6-carboxylic acid

: 138625-85-1
(1-benzyl-4-methylhexahydro-1H-1,4-diazepin-6-yl)methanol

Guidance literature:: Multi-step reaction with 2 steps

1: 85 percent / thionyl chloride / 3 h / Ambient temperature

2: 66 percent / sodium bis(2-methoxyethoxy)aluminum hydride / toluene / a) 5 deg C, 0.5 h, b) RT, 12 h

With thionyl chloride; sodium bis(2-methoxyethoxy)aluminium dihydride; In toluene;
DOI:10.1248/cpb.43.1912