2'-Benzyl-2,2-dimethylpropionanilide

Base Information

Chemical Name:2'-Benzyl-2,2-dimethylpropionanilide
CAS No.:85864-33-1
Molecular Formula:C18H21 N O
Molecular Weight:267.371
Hs Code.:29242990
European Community (EC) Number:623-321-3
DSSTox Substance ID:DTXSID40352914
Nikkaji Number:J2.099.109G
Wikidata:Q82130336
Mol file:85864-33-1.mol

Synonyms:85864-33-1;2'-Benzyl-2,2-dimethylpropionanilide;N-(2-Benzylphenyl)pivalamide;N-(2-benzylphenyl)-2,2-dimethylpropanamide;N-Pivaloyl-o-benzylaniline;Maybridge4_002059;N-Pivaloyl-o-benzylanilin;Oprea1_843774;SCHEMBL1274654;DTXSID40352914;HMS1526N13;CCG-42395;AKOS001045125;NCGC00176965-01;AS-59632;2'-Benzyl-2,2-dimethylpropionanilide, 99%;CS-0362067;SR-01000632398-1;BRD-K15816034-001-01-5;Z26763419

Suppliers and Price of 2'-Benzyl-2,2-dimethylpropionanilide

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

Crysdot
N-(2-Benzylphenyl)pivalamide 95+%
25g
$ 344.00

American Custom Chemicals Corporation
2'-BENZYL-2,2-DIMETHYLPROPIONANILIDE 99.00%
5G
$ 928.97

American Custom Chemicals Corporation
2'-BENZYL-2,2-DIMETHYLPROPIONANILIDE 99.00%
1G
$ 649.91

Total 6 raw suppliers

Chemical Property of 2'-Benzyl-2,2-dimethylpropionanilide

Chemical Property:

Vapor Pressure:8.55E-08mmHg at 25°C
Melting Point:88-90 °C(lit.)
Refractive Index:1.5500 (estimate)
Boiling Point:435.7°C at 760 mmHg
Flash Point:266.3°C
PSA：29.10000
Density:1.063g/cm³
LogP:4.33500
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:267.162314293
Heavy Atom Count:20
Complexity:312

Purity/Quality:

97% ^*data from raw suppliers

N-(2-Benzylphenyl)pivalamide 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC(C)(C)C(=O)NC1=CC=CC=C1CC2=CC=CC=C2

Technology Process of 2'-Benzyl-2,2-dimethylpropionanilide

There total 2 articles about 2'-Benzyl-2,2-dimethylpropionanilide 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: 90.0%

: 28059-64-5
2-benzylaniline

: 3282-30-2
pivaloyl chloride

: 85864-33-1
phenyl(2-pivaloylamidophenyl)methane

Guidance literature:: With triethylamine; In dichloromethane; at 0 ℃; for 0.5h;
DOI:10.1021/jo00263a052

Reference yield:

: 2835-77-0
(2-aminophenyl)(phenyl)methanone

: 85864-33-1
phenyl(2-pivaloylamidophenyl)methane

Guidance literature:: Multi-step reaction with 2 steps

1: 90 percent / Na / ethanol

2: 80 percent / sodium carbonate / CH₂Cl₂ / 3 h / Ambient temperature

With sodium; sodium carbonate; In ethanol; dichloromethane;

Reference yield:

: 2788-86-5
4-Chlorostyrene oxide

: 85864-33-1
phenyl(2-pivaloylamidophenyl)methane

: C₂₆H₂₈ClNO₂

: C₂₆H₂₈ClNO₂

: C₂₆H₂₈ClNO₂

: 2788-86-5,53649-47-1,97466-49-4,21019-51-2
(R)-2-(4-chlorophenyl)oxirane

: 2788-86-5,21019-51-2,53649-47-1,97466-49-4
(2S)-2-(4-chlorophenyl)oxirane

Guidance literature:: phenyl(2-pivaloylamidophenyl)methane; With n-butyllithium; sparteine; In tert-butyl methyl ether; at -20 ℃; for 1h;

4-Chlorostyrene oxide; In tert-butyl methyl ether; at -78 ℃; for 0.333333h; stereoselective reaction; Resolution of racemate;
DOI:10.1002/bkcs.10256