1'-(2-(4-Chlorophenyl)-2-hydroxyethyl)spiro(4H-3,1-benzoxazine-4,4'-piperidin)-2(1H)-one

Base Information

Chemical Name:1'-(2-(4-Chlorophenyl)-2-hydroxyethyl)spiro(4H-3,1-benzoxazine-4,4'-piperidin)-2(1H)-one
CAS No.:85732-30-5
Molecular Formula:C20H21ClN2O3
Molecular Weight:372.8453
Hs Code.:
DSSTox Substance ID:DTXSID001006348

Synonyms:1'-(2-(4-Chlorophenyl)-2-hydroxyethyl)spiro(4H-3,1-benzoxazine-4,4'-piperidin)-2(1H)-one;Spiro(4H-3,1-benzoxazine-4,4'-piperidin)-2(1H)-one, 1'-(2-(4-chlorophenyl)-2-hydroxyethyl)-;85732-30-5;DTXSID001006348;LS-145943;1'-[2-(4-Chlorophenyl)-2-hydroxyethyl]spiro[3,1-benzoxazine-4,4'-piperidin]-2-ol

Suppliers and Price of 1'-(2-(4-Chlorophenyl)-2-hydroxyethyl)spiro(4H-3,1-benzoxazine-4,4'-piperidin)-2(1H)-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of 1'-(2-(4-Chlorophenyl)-2-hydroxyethyl)spiro(4H-3,1-benzoxazine-4,4'-piperidin)-2(1H)-one

Chemical Property:

Boiling Point:515.5°Cat760mmHg
Flash Point:265.6°C
Density:1.38g/cm³
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:372.1240702
Heavy Atom Count:26
Complexity:501

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN(CCC12C3=CC=CC=C3NC(=O)O2)CC(C4=CC=C(C=C4)Cl)O

Technology Process of 1'-(2-(4-Chlorophenyl)-2-hydroxyethyl)spiro(4H-3,1-benzoxazine-4,4'-piperidin)-2(1H)-one

There total 7 articles about 1'-(2-(4-Chlorophenyl)-2-hydroxyethyl)spiro(4H-3,1-benzoxazine-4,4'-piperidin)-2(1H)-one 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: 72.7%

: 85732-56-5
C₂₀H₁₉ClN₂O₃

: 85732-30-5
C₂₀H₂₁ClN₂O₃

Guidance literature:: With sodium tetrahydroborate; In ethanol; for 72h; Ambient temperature;
DOI:10.1248/cpb.33.1129

Reference yield:

: 3612-20-2
1-phenylmethyl-4-piperidone

: 85732-30-5
C₂₀H₂₁ClN₂O₃

Guidance literature:: Multi-step reaction with 7 steps

1: 45.4 percent / n-butyllithium / hexane; tetrahydrofuran / -5 °C

2: 62.4 percent / 3 N H₂SO₄ / H₂O / 16 h / Heating

3: pyridine / 0 °C

4: aq. NaOH / methanol

5: 85.5 percent / hydrogen, 1N HCl / 10percent Pd-C / H₂O; methanol / 20 h / 40 °C

6: 83 percent / TEA / ethanol / Ambient temperature

7: 72.7 percent / NaBH₄ / ethanol / 72 h / Ambient temperature

With pyridine; hydrogenchloride; sodium hydroxide; sodium tetrahydroborate; n-butyllithium; TEA; sulfuric acid; hydrogen; palladium on activated charcoal; In tetrahydrofuran; methanol; ethanol; hexane; water;
DOI:10.1248/cpb.33.1129

Reference yield:

: 65854-91-3
N-(4-chlorophenyl)-2,2-dimethylpropionamide

: 85732-30-5
C₂₀H₂₁ClN₂O₃

Guidance literature:: Multi-step reaction with 7 steps

1: 45.4 percent / n-butyllithium / hexane; tetrahydrofuran / -5 °C

2: 62.4 percent / 3 N H₂SO₄ / H₂O / 16 h / Heating

3: pyridine / 0 °C

4: aq. NaOH / methanol

5: 85.5 percent / hydrogen, 1N HCl / 10percent Pd-C / H₂O; methanol / 20 h / 40 °C

6: 83 percent / TEA / ethanol / Ambient temperature

7: 72.7 percent / NaBH₄ / ethanol / 72 h / Ambient temperature

With pyridine; hydrogenchloride; sodium hydroxide; sodium tetrahydroborate; n-butyllithium; TEA; sulfuric acid; hydrogen; palladium on activated charcoal; In tetrahydrofuran; methanol; ethanol; hexane; water;
DOI:10.1248/cpb.33.1129