2,2-dimethyl-N-[(1R)-1-phenylethyl]propanamide

Base Information

Chemical Name:2,2-dimethyl-N-[(1R)-1-phenylethyl]propanamide
CAS No.:91797-84-1
Molecular Formula:C13H19NO
Molecular Weight:205.3
Hs Code.:
European Community (EC) Number:618-791-1
DSSTox Substance ID:DTXSID601248168
Nikkaji Number:J1.284.959A
Mol file:91797-84-1.mol

Synonyms:91797-84-1;2,2-dimethyl-N-[(1R)-1-phenylethyl]propanamide;(R)-N-(1-Phenylethyl)pivalamide;Propanamide, 2,2-dimethyl-N-[(1R)-1-phenylethyl]-;SCHEMBL2903965;HBBKPRZFGXDWHG-SNVBAGLBSA-N;DTXSID601248168;MFCD20230519;N-[(R)-alpha-Methylbenzyl]pivalamide;AKOS013019014;AS-68215;CS-0008768;N-[(1R)-1-phenylethyl]-2,2-dimethylpropanamide

Suppliers and Price of 2,2-dimethyl-N-[(1R)-1-phenylethyl]propanamide

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
2,2-Dimethyl-N-[(1R)-1-phenylethyl]propanamide
2.5g
$ 330.00

Crysdot
(R)-N-(1-Phenylethyl)pivalamide 95+%
5g
$ 727.00

Alichem
2,2-Dimethyl-n-[(1r)-1-phenylethyl]propanamide
5g
$ 336.14

Alichem
2,2-Dimethyl-n-[(1r)-1-phenylethyl]propanamide
25g
$ 1029.00

AK Scientific
2,2-dimethyl-N-[(1R)-1-phenylethyl]propanamide
100g
$ 2352.80

AK Scientific
2,2-dimethyl-N-[(1R)-1-phenylethyl]propanamide
25g
$ 963.20

Total 4 raw suppliers

Chemical Property of 2,2-dimethyl-N-[(1R)-1-phenylethyl]propanamide

Chemical Property:

Melting Point:119-119.5 °C(Solv: hexane (110-54-3))
Boiling Point:353.0±21.0 °C(Predicted)
PKA:15?+-.0.46(Predicted)
PSA：29.10000
Density:0.970±0.06 g/cm3(Predicted)
LogP:3.30080
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:205.146664230
Heavy Atom Count:15
Complexity:211

Purity/Quality:

99% ^*data from raw suppliers

2,2-Dimethyl-N-[(1R)-1-phenylethyl]propanamide ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C1=CC=CC=C1)NC(=O)C(C)(C)C
Isomeric SMILES:C[C@H](C1=CC=CC=C1)NC(=O)C(C)(C)C

Technology Process of 2,2-dimethyl-N-[(1R)-1-phenylethyl]propanamide

There total 6 articles about 2,2-dimethyl-N-[(1R)-1-phenylethyl]propanamide 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: 99.0%

: 3886-69-9
(R)-1-phenyl-ethyl-amine

: 3282-30-2
pivaloyl chloride

: 91797-84-1
(R)-(+)-N-(1-phenylethyl)-2,2-dimethylpropanamide

Guidance literature:: With 1-methyl-1H-imidazole; In dichloromethane; at 0 ℃; Inert atmosphere;
DOI:10.1021/ol900357d

Reference yield: 60.0%

: 3886-69-9
(R)-1-phenyl-ethyl-amine

: 630-19-3
pivalaldehyde

: 91797-84-1
(R)-(+)-N-(1-phenylethyl)-2,2-dimethylpropanamide

Guidance literature:: With bis(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate; caesium carbonate; methacrylic acid methyl ester; tricyclohexylphosphine; In tetrahydrofuran; at 80 ℃; for 24h; enantiospecific reaction;
DOI:10.1021/acscatal.6b02541

Reference yield:

: 75-98-9
Trimethylacetic acid

: 91797-84-1
(R)-(+)-N-(1-phenylethyl)-2,2-dimethylpropanamide

Guidance literature:: Multi-step reaction with 2 steps

1: CCl₄; K₂CO₃ / benzyltriethylammonium chloride / toluene / 0.17 h / 55 °C

2: toluene / 0.17 h / 55 °C

With tetrachloromethane; potassium carbonate; N-benzyl-N,N,N-triethylammonium chloride; In toluene; 1: Condensation / 2: Substitution;
DOI:10.1080/00397919808004849