1-Benzylpiperidine-2-carbaldehyde

Base Information

Chemical Name:1-Benzylpiperidine-2-carbaldehyde
CAS No.:157634-01-0
Molecular Formula:C13H17NO
Molecular Weight:203.28000
Hs Code.:2933399090
DSSTox Substance ID:DTXSID70591596
Mol file:157634-01-0.mol

Synonyms:1-Benzyl-piperidine-2-carbaldehyde;157634-01-0;1-benzylpiperidine-2-carbaldehyde;(2R)-1-BENZYLPIPERIDINE-2-CARBALDEHYDE;(2S)-1-BENZYLPIPERIDINE-2-CARBALDEHYDE;SCHEMBL1300042;DTXSID70591596;AKOS011948130;AM100300;DB-311862;CS-0358106

Suppliers and Price of 1-Benzylpiperidine-2-carbaldehyde

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

TRC
1-benzylpiperidine-2-carbaldehyde
50mg
$ 130.00

Labseeker
1-benzylpiperidine-2-carbaldehyde 95
10g
$ 2108.00

Labseeker
1-benzylpiperidine-2-carbaldehyde 95
5g
$ 1550.00

Chemenu
1-Benzyl-piperidine-2-carbaldehyde 95%
1g
$ 764.00

American Custom Chemicals Corporation
1-BENZYLPIPERIDINE-2-CARBALDEHYDE 95.00%
5MG
$ 496.09

Total 6 raw suppliers

Chemical Property of 1-Benzylpiperidine-2-carbaldehyde

Chemical Property:

Boiling Point:299.5±33.0 °C(Predicted)
PKA:7.68±0.10(Predicted)
PSA：20.31000
Density:1.114±0.06 g/cm3(Predicted)
LogP:2.17790
XLogP3:2.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:203.131014166
Heavy Atom Count:15
Complexity:199

Purity/Quality:

95% ^*data from raw suppliers

1-benzylpiperidine-2-carbaldehyde ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCN(C(C1)C=O)CC2=CC=CC=C2

Technology Process of 1-Benzylpiperidine-2-carbaldehyde

There total 5 articles about 1-Benzylpiperidine-2-carbaldehyde 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: 79.0%

: 137650-02-3,85387-43-5
(1-benzylpiperidin-2-yl)methanol

: 157634-01-0
N-benzylpiperidine-2-carbaldehyde

Guidance literature:: With oxalyl dichloride; dimethyl sulfoxide; triethylamine; In dichloromethane; at -78 - 20 ℃; Inert atmosphere;
DOI:10.1021/ol102536s

Reference yield:

: 98-88-4
benzoyl chloride

: 157634-01-0
N-benzylpiperidine-2-carbaldehyde

Guidance literature:: Multi-step reaction with 3 steps

1: NaOH / H₂O / 2 h / 0 °C

2: LiAlH₄ / tetrahydrofuran / 1.) 0 deg C, 1 h, 2.) reflux, 16 h

3: 1.) DMSO, oxalyl chloride, 2.) Et₃N / 1.) CH₂Cl₂, -40 deg C, 15 min, 2.) -40 deg C, 0.5 g

With sodium hydroxide; lithium aluminium tetrahydride; oxalyl dichloride; dimethyl sulfoxide; triethylamine; In tetrahydrofuran; water;
DOI:10.1021/jo951829c

Reference yield:

: 78348-46-6
N-benzoyl-2-piperidinecarboxylic acid

: 157634-01-0
N-benzylpiperidine-2-carbaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: LiAlH₄ / tetrahydrofuran / 1.) 0 deg C, 1 h, 2.) reflux, 16 h

2: 1.) DMSO, oxalyl chloride, 2.) Et₃N / 1.) CH₂Cl₂, -40 deg C, 15 min, 2.) -40 deg C, 0.5 g

With lithium aluminium tetrahydride; oxalyl dichloride; dimethyl sulfoxide; triethylamine; In tetrahydrofuran;
DOI:10.1021/jo951829c