[(1R)-1-phosphonatohexyl]azanium

Base Information

Chemical Name:[(1R)-1-phosphonatohexyl]azanium
CAS No.:63207-60-3
Molecular Formula:C₆H₁₆NO₃P
Molecular Weight:181.172
Hs Code.:2931900090
DSSTox Substance ID:DTXSID50427344
Wikidata:Q82240005
Mol file:63207-60-3.mol

Synonyms:[(1R)-1-phosphonatohexyl]azanium;[(1R)-1-phosphonatohexyl]ammonium;DTXSID50427344;A834272

Suppliers and Price of [(1R)-1-phosphonatohexyl]azanium

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

American Custom Chemicals Corporation
(1-AMINO HEXYL)PHOSPHONIC ACID 95.00%
1G
$ 164.01

AHH
(1-Aminohexyl)phosphonicacid 97%
5g
$ 560.00

Total 10 raw suppliers

Chemical Property of [(1R)-1-phosphonatohexyl]azanium

Chemical Property:

Vapor Pressure:2.57E-05mmHg at 25°C
Melting Point:270-276 °C(lit.)
Boiling Point:333.7°C at 760 mmHg
PKA:0.92±0.10(Predicted)
Flash Point:155.6°C
PSA：93.36000
Density:1.201g/cm³
LogP:1.72950
XLogP3:-2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:180.07895534
Heavy Atom Count:11
Complexity:133

Purity/Quality:

97% ^*data from raw suppliers

(1-AMINO HEXYL)PHOSPHONIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

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

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCC([NH3+])P(=O)([O-])[O-]
Isomeric SMILES:CCCCC[C@H]([NH3+])P(=O)([O-])[O-]

Technology Process of [(1R)-1-phosphonatohexyl]azanium

There total 6 articles about [(1R)-1-phosphonatohexyl]azanium 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: 58.0%

: 77526-43-3
dl-(1-aminohexyl)phosphonic acid diethyl ester

: 63207-60-3,109638-78-0,308103-42-6,342385-57-3
α-aminohexanephosphonic acid

Guidance literature:: With hydrogenchloride; In acetic acid; for 8h; Heating;
DOI:10.1055/s-1980-29311

Reference yield:

: 6281-07-8
hexanoyl-phosphonic acid diethyl ester

: 63207-60-3,109638-78-0,308103-42-6,342385-57-3
α-aminohexanephosphonic acid

Guidance literature:: Multi-step reaction with 3 steps

1: 84 percent / acetic acid / 1 h / Ambient temperature

2: 70 percent / Zn / acetic acid; trifluoroacetic acid / 2 h / Ambient temperature

3: 58 percent / HCl aq. / acetic acid / 8 h / Heating

With hydrogenchloride; zinc; In acetic acid; trifluoroacetic acid;
DOI:10.1055/s-1980-29311

Reference yield:

: 77526-39-7
[1-(Dimethyl-hydrazono)-hexyl]-phosphonic acid diethyl ester

: 63207-60-3,109638-78-0,308103-42-6,342385-57-3
α-aminohexanephosphonic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 70 percent / Zn / acetic acid; trifluoroacetic acid / 2 h / Ambient temperature

2: 58 percent / HCl aq. / acetic acid / 8 h / Heating

With hydrogenchloride; zinc; In acetic acid; trifluoroacetic acid;
DOI:10.1055/s-1980-29311