4-(2-Methylbutoxy)aniline

Base Information

Chemical Name:4-(2-Methylbutoxy)aniline
CAS No.:112418-54-9
Molecular Formula:C11H17 N O
Molecular Weight:179.262
Hs Code.:2922299090
DSSTox Substance ID:DTXSID50695763
Nikkaji Number:J2.880.258G
Mol file:112418-54-9.mol

Synonyms:4-(2-Methylbutoxy)aniline;DTXSID50695763;AKOS011382722;SB30750;FT-0692303

Suppliers and Price of 4-(2-Methylbutoxy)aniline

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

Total 7 raw suppliers

Chemical Property of 4-(2-Methylbutoxy)aniline

Chemical Property:

Boiling Point:287.7±13.0 °C(Predicted)
PKA:5.24±0.10(Predicted)
PSA：35.25000
Density:0.984±0.06 g/cm3(Predicted)
LogP:3.27490
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:179.131014166
Heavy Atom Count:13
Complexity:130

Purity/Quality:: 98% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(C)COC1=CC=C(C=C1)N

Technology Process of 4-(2-Methylbutoxy)aniline

There total 4 articles about 4-(2-Methylbutoxy)aniline 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%

: 1991-59-9
(S)-(+)-4-(2-methyl-1-butoxy)nitrobenzene

: 112418-54-9
4-<(S)-2-methylbutoxy>aniline

Guidance literature:: With hydrogenchloride; iron; In ethanol; water; for 2h; Heating;
DOI:10.1002/1099-0682(20011)2001:1<111::aid-ejic111>3.3.co;2-0

Reference yield:

: 100-02-7,78813-13-5,89830-32-0
4-nitro-phenol

: 534-00-9
(S)-2-methylbutyl bromide

: 112418-54-9
4-<(S)-2-methylbutoxy>aniline

Guidance literature:: With hydrogen; palladium on activated charcoal; Multistep reaction;
DOI:10.1246/bcsj.59.3965

Reference yield:

: 100-02-7,78813-13-5,89830-32-0
4-nitro-phenol

: 112418-54-9
4-<(S)-2-methylbutoxy>aniline

Guidance literature:: Multi-step reaction with 2 steps

1: 84 percent / NaH / dimethylformamide / 4 h / 80 °C

2: 86 percent / Fe; HCl / ethanol; H₂O / 2 h / Heating

With hydrogenchloride; iron; sodium hydride; In ethanol; water; N,N-dimethyl-formamide;
DOI:10.1002/1099-0682(20011)2001:1<111::aid-ejic111>3.3.co;2-0