4-Hydroxymandelonitrile

Base Information

Chemical Name:4-Hydroxymandelonitrile
CAS No.:13093-65-7
Molecular Formula:C8H7 N O2
Molecular Weight:149.149
Hs Code.:2926909090
European Community (EC) Number:636-190-2
DSSTox Substance ID:DTXSID20926975
Nikkaji Number:J30.668A
Wikidata:Q27102830
Mol file:13093-65-7.mol

Synonyms:4-hydroxymandelonitrile;4-hydroxymandelonitrile, (DL)-isomer;para-hydroxymandelonitrile

Suppliers and Price of 4-Hydroxymandelonitrile

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

AK Scientific
4-Hydroxymandelonitrile
5g
$ 556.00

Alichem
2-Hydroxy-2-(4-hydroxyphenyl)acetonitrile
10g
$ 526.90

Crysdot
2-Hydroxy-2-(4-hydroxyphenyl)acetonitrile 97%
10g
$ 479.00

TCI Chemical
DL-4-Hydroxymandelonitrile >98.0%(N)
5g
$ 361.00

TRC
DL-4-Hydroxymandelonitrile
500mg
$ 200.00

Total 9 raw suppliers

Chemical Property of 4-Hydroxymandelonitrile

Chemical Property:

Vapor Pressure:5.32E-06mmHg at 25°C
Melting Point:96.0 to 99.0 °C
Boiling Point:366°Cat760mmHg
PKA:9.35±0.26(Predicted)
Flash Point:175.1°C
PSA：64.25000
Density:1.327g/cm³
LogP:0.94918
Solubility.:soluble in Methanol
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:149.047678466
Heavy Atom Count:11
Complexity:164

Purity/Quality:

97% ^*data from raw suppliers

4-Hydroxymandelonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C(C#N)O)O

Technology Process of 4-Hydroxymandelonitrile

There total 8 articles about 4-Hydroxymandelonitrile 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: 90.0%

: 151-50-8
potassium cyanide

: 123-08-0,65581-83-1
4-hydroxy-benzaldehyde

: 13093-65-7
2-hydroxy2-(4-hydroxyphenyl)acetonitrile

Guidance literature:: In water; acetic acid; for 1h; Ambient temperature;

Reference yield: 86.0%

: 7677-24-9
trimethylsilyl cyanide

: 123-08-0,65581-83-1
4-hydroxy-benzaldehyde

: 13093-65-7
2-hydroxy2-(4-hydroxyphenyl)acetonitrile

Guidance literature:: In water; dimethyl sulfoxide; at 20 ℃; for 12h;
DOI:10.5935/0103-5053.20150102

Reference yield:

: 613-90-1
benzoyl cyanide

: 123-08-0,65581-83-1
4-hydroxy-benzaldehyde

: 13093-65-7
2-hydroxy2-(4-hydroxyphenyl)acetonitrile

: 5230-33-1
2-Hydroxy-2-(4-hydroxyphenyl)-1-phenylethanone

: 134-81-6
benzil

Guidance literature:: With titanium(III) chloride; potassium carbonate; acetic acid; Yield given. Multistep reaction. Yields of byproduct given; 1) water, 2 h, r.t., 2) t-BuOH, 4 h, 35 deg C;
DOI:10.1021/jo00062a038