(S)-1-Phenylbutylamine

Base Information

Chemical Name:(S)-1-Phenylbutylamine
CAS No.:3789-60-4
Molecular Formula:C10H15N
Molecular Weight:149.236
Hs Code.:2921499090
European Community (EC) Number:662-956-0
DSSTox Substance ID:DTXSID50368708
Nikkaji Number:J57.118K
Wikidata:Q72501420
Mol file:3789-60-4.mol

Synonyms:(S)-1-PHENYLBUTYLAMINE;3789-60-4;(S)-1-phenylbutan-1-amine;(1S)-1-phenylbutan-1-amine;MFCD08064291;(s)-alpha-phenylbutylamine;(S)-1-(phenyl)-butylamine;(S)-1-Phenyl-1-butanamine;SCHEMBL170739;(S)-1-Amino-1-phenylbutane;DTXSID50368708;XHOXKVFLASIOJD-JTQLQIEISA-N;AKOS015842995;AS-58607;CS-0205599;A22174;Y11944;(S)-1-Phenylbutylamine, ChiPros(R), produced by BASF, 99%

Suppliers and Price of (S)-1-Phenylbutylamine

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
(S)-1-Phenylbutan-1-amine 95+%
5g
$ 298.00

American Custom Chemicals Corporation
(S)-1-PHENYLBUTYLAMINE 95.00%
1G
$ 227.64

American Custom Chemicals Corporation
(S)-1-PHENYLBUTYLAMINE 95.00%
5G
$ 2454.38

Alichem
(S)-1-Phenylbutan-1-amine
5g
$ 301.00

Alfa Aesar
(S)-1-Phenylbutylamine, ChiPros?, 98%, ee 98+%
5g
$ 341.00

Alfa Aesar
(S)-1-Phenylbutylamine, ChiPros?, 98%, ee 98+%
1g
$ 115.00

AK Scientific
(S)-1-Phenylbutylamine
1g
$ 249.00

AHH
(S)-1-Phenylbutylamine 98%
10g
$ 758.00

Total 23 raw suppliers

Chemical Property of (S)-1-Phenylbutylamine

Chemical Property:

Vapor Pressure:0.094mmHg at 25°C
Refractive Index:1.521
Boiling Point:223.9 °C at 760mmHg
PKA:9.31±0.10(Predicted)
Flash Point:93.8°C
PSA：26.02000
Density:0.934g/cm³
LogP:3.18680
Storage Temp.:under inert gas (nitrogen or Argon) at 2–8 °C
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%, ^*data from raw suppliers

(S)-1-Phenylbutan-1-amine 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s): C,N
Hazard Codes:C,N
Statements: 22-34-51/53
Safety Statements: 26-36/37/39-45-61

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC(C1=CC=CC=C1)N
Isomeric SMILES:CCC[C@@H](C1=CC=CC=C1)N

Technology Process of (S)-1-Phenylbutylamine

There total 43 articles about (S)-1-Phenylbutylamine 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: 98.0%

: 1315613-42-3
C₁₄H₂₃NOS

: 2941-19-7,3789-60-4,6150-01-2,62311-56-2
(R)-1-phenylbutylamine

Guidance literature:: With hydrogenchloride; In methanol; diethyl ether; at 0 - 20 ℃; for 3h; Inert atmosphere;
DOI:10.15227/orgsyn.090.0338

Reference yield: 94.0%

: C₁₄H₂₁NOS

: 2941-19-7,3789-60-4,6150-01-2,62311-56-2
(R)-1-phenylbutylamine

Guidance literature:: C₁₄H₂₁NOS; With [RhCl₂(p-cymene)]2; potassium tert-butylate; 2-Amino-2-methyl-1-propanol; isopropyl alcohol; at 50 ℃; for 0.5h; Inert atmosphere; Microwave irradiation; Molecular sieve;

With hydrogenchloride; In methanol; at 20 ℃; enantioselective reaction; Inert atmosphere;
DOI:10.1002/ejoc.201402884

Reference yield: 86.0%

: 2941-19-7
1-phenyl-butylamine

: 3789-60-4
(S)-1-amino-1-phenylbutane

: 2941-19-7,3789-60-4,6150-01-2,62311-56-2
(R)-1-phenylbutylamine

Guidance literature:: With pyridoxal 5'-phosphate; Glyoxilic acid; In aq. phosphate buffer; at 37 ℃; for 30h; pH=7; enantioselective reaction; Resolution of racemate; Enzymatic reaction;
DOI:10.1002/adsc.201500239