4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol

Base Information Edit

Chemical Name:4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol
CAS No.:69088-96-6
Molecular Formula:C11H13NO
Molecular Weight:175.23
Hs Code.:2922199090
DSSTox Substance ID:DTXSID6071954
Nikkaji Number:J441.286I
Wikidata:Q72440693
Mol file:69088-96-6.mol

Synonyms:69088-96-6;4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol;4-(3-aminophenyl)-2-methylbut-3-yn-2-ol;3-Butyn-2-ol, 4-(3-aminophenyl)-2-methyl-;1-(3-Aminophenyl)-3-methyl-1-butyn-3-ol;SCHEMBL471131;DTXSID6071954;BCP24710;MFCD06200785;AKOS015854592;AS-19753;2-Methyl-4-(3-aminophenyl)-3-butyn-2-ol;CS-0213047;FT-0641220;3-Butyn-2-ol,4-(3-aminophenyl)-2-methyl-;3-(3-Hydroxy-3-methyl-1-butyn-1-yl)aniline;T71233;A836350;F2167-6945

Suppliers and Price of 4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol

Supply Marketing:Edit

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

TCI Chemical
4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol >98.0%(GC)
5g
$ 99.00

Crysdot
4-(3-Aminophenyl)-2-methylbut-3-yn-2-ol 95+%
10g
$ 323.00

Chemenu
4-(3-Aminophenyl)-2-methylbut-3-yn-2-ol 95%
10g
$ 305.00

American Custom Chemicals Corporation
4-(3-AMINOPHENYL)-2-METHYL-3-BUTYN-2-OL 95.00%
5G
$ 958.92

Alichem
4-(3-Aminophenyl)-2-methylbut-3-yn-2-ol
5g
$ 206.70

AK Scientific
4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol
250mg
$ 46.00

AK Scientific
4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol
5g
$ 205.00

AHH
4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol 98%
25g
$ 450.00

Activate Scientific
4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol 95%
1 g
$ 150.00

Activate Scientific
4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol 95%
5 g
$ 428.00

Total 42 raw suppliers

Chemical Property of 4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol Edit

Chemical Property:

Vapor Pressure:3.38E-05mmHg at 25°C
Melting Point:120 °C
Refractive Index:1.591
Boiling Point:340.2 °C at 760 mmHg
PKA:12.99±0.29(Predicted)
Flash Point:159.5 °C
PSA：46.25000
Density:1.11 g/cm³
LogP:1.97240
Solubility.:soluble in Methanol
XLogP3:1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:175.099714038
Heavy Atom Count:13
Complexity:233

Purity/Quality:

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

4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol >98.0%(GC) ^*data from reagent suppliers

Safty Information:

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

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C#CC1=CC(=CC=C1)N)O
Uses 4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol is used as a reactant in the cross-coupling reaction of aromatics and heteroaromatics with alkynes.

Technology Process of 4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol

There total 9 articles about 4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol 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: 86.0%

: 115-19-5
2-methyl-but-3-yn-2-ol

: 591-19-5
m-Bromoaniline

: 69088-96-6
2-methyl-4-(3-aminophenyl)-3-butyn-2-ol

Guidance literature:: With palladium diacetate; 1,8-diazabicyclo[5.4.0]undec-7-ene; Tri(p-tolyl)phosphine; In tetrahydrofuran; at 80 ℃; for 6h; Solvent; Reagent/catalyst; Inert atmosphere; Schlenk technique;
DOI:10.3762/bjoc.10.36

Reference yield: 84.0%

: 50624-25-4
4-hydroxy-4-methyl-2-pentynoic acid

: 591-19-5
m-Bromoaniline

: 69088-96-6
2-methyl-4-(3-aminophenyl)-3-butyn-2-ol

Guidance literature:: With tetrabutyl ammonium fluoride; dicyclohexyl-(2',6'-dimethoxybiphenyl-2-yl)-phosphane; palladium diacetate; In tetrahydrofuran; at 80 ℃; Product distribution / selectivity; Inert atmosphere;