Phenpromethamine

Base Information

• Chemical Name: Phenpromethamine
• CAS No.: 93-88-9
• Deprecated CAS: 6152-73-4
• Molecular Formula: C10H15 N
• Molecular Weight: 149.236
• Hs Code.: 2921499090
• European Community (EC) Number: 823-163-7
• UNII: 7D4542I59V
• DSSTox Substance ID: DTXSID20861690
• Nikkaji Number: J4.687F
• Wikipedia: Phenpromethamine
• Wikidata: Q7181405
• NCI Thesaurus Code: C167019
• ChEMBL ID: CHEMBL1622886
• Mol file: 93-88-9.mol

Synonyms:PHENPROMETHAMINE;Methyl-(2-phenyl-propyl)-amine;N-methyl-2-phenylpropan-1-amine;Vonedrine;93-88-9;Phenpromethaminum;N-Methyl-2-phenylpropylamine;Fenprometamina;methyl(2-phenylpropyl)amine;Phenpromethadrinum;1-Methylamino-2-phenylpropane;1-Methylamino-2-methyl-2-phenylethane;N,beta-Dimethylphenethylamine;Phenpromethamine [INN:DCF];Fenprometamina [INN-Spanish];Phenpromethaminum [INN-Latin];Dl-n-methyl-2-phenylpropylamine;UNII-7D4542I59V;7D4542I59V;1-Phenyl-1-methyl-2-methylaminoethane;BRN 3196526;1-Phenyl-1-methyl-2-methylamino-aethan;1-Phenyl-1-methyl-2-methylamino-aethan [German];3-12-00-02689 (Beilstein Handbook Reference);Phenpromethamin;MLS000708563;SMR000289130;Phenpromethadrine;Phenpromethamine [DCF:INN];methyl-(2-phenylpropyl)amine;cid_22275;PHENPROMETHAMINE [INN];SCHEMBL681384;N,beta-Dimethylbenzeneethanamine;dl-N,beta-dimethylphenethylamine;CHEMBL1622886;PHENPROMETHAMINE [MART.];BDBM96687;DTXSID20861690;N-Methyl-2-phenyl-1-propylamine;CHEBI:134771;N-Methyl-beta-Methylphenethylamine;HMS1691M02;PHENYLPROPYLMETHYLAMINE [MI];STK511146;AKOS000302817;AKOS017269518;N,.BETA.-DIMETHYLPHENETHYLAMINE;hydrochloride;NCGC00245147-01;N,.BETA.-DIMETHYLBENZENEETHANAMINE;PHENETHYLAMINE, N,.BETA.-DIMETHYL-;DL-N,.BETA.-DIMETHYLBENZENEETHANAMINE;methyl-(2-phenyl-propyl)-amine, AldrichCPR;(+/-)-1-METHYLAMINO-2-PHENYLPROPANE;BENZENEETHANAMINE, N,.BETA.-DIMETHYL-;EN300-66712;N-methyl-2-phenyl-1-propanamine;N-methyl-2-phenyl-propan-1-amine;Phenethylamine, N,.beta.-dimethyl-, (.+.)-;Benzeneethanamine, N,.beta.-dimethyl-, (.+.)-;Q7181405;Z57797325;6152-73-4

Chemical Property of Phenpromethamine

Chemical Property:

• Vapor Pressure: 0.199mmHg at 25°C
• Melting Point: 143°C (estimate)
• Refractive Index: nD20 1.5102
• Boiling Point: 209.8°C at 760 mmHg
• PKA: 10.35±0.20(Predicted)
• Flash Point: 81.4°C
• PSA: 12.03000
• Density: 0.905g/cm³
• LogP: 2.40040
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 149.120449483
• Heavy Atom Count: 11
• Complexity: 95

Purity/Quality:

99% ,98%,Electron Grade , ^*data from raw suppliers

N-methyl-2-phenylpropan-1-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CNC)C1=CC=CC=C1

Technology Process of Phenpromethamine

There total 12 articles about Phenpromethamine 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: 69.0%

N-methylhydroxylamine-O-sulphonic acid (3400-11-1) + isopropenylbenzene (98-83-9,6144-04-3,25014-31-7,42612-14-6) → phenpromethamine (93-88-9)

Guidance literature:

isopropenylbenzene; With Schwartz's reagent; In tetrahydrofuran; at 25 ℃;

N-methylhydroxylamine-O-sulphonic acid; In tetrahydrofuran; at 50 ℃; for 0.5h;

DOI:10.1021/jo401498w

Reference yield: 60.0%

N-methyl-1-phenyl-1-methylacetamide (13490-93-2,58265-30-8) → phenpromethamine (93-88-9)

Guidance literature:

With 1,1,3,3-Tetramethyldisiloxane; (μ₃,η²,η³,η⁵-acenaphthylene)Ru(CO)7; In 1,2-dimethoxyethane; at 60 ℃; for 12h;

DOI:10.1021/jo070591c

Reference yield:

methylamine (74-89-5) → phenpromethamine (93-88-9) + isopropenylbenzene (98-83-9,6144-04-3,25014-31-7,42612-14-6)

Guidance literature:

With ethanol;

upstream raw materials:

2-phenylpropylamine

formaldehyd

2-Phenylpropanal

methylamine

Downstream raw materials:

(+/-)-trans-cinnamyl-methyl-(2-phenyl-propyl)-amine

C₁₀H₁₄N₂O

[R]-(+)-N-methyl-2-phenylpropylamine

[S]-(-)-N-methyl-2-phenylpropylamine