Methyl 3-cyano-4-hydroxybenzoate

Base Information

Chemical Name:Methyl 3-cyano-4-hydroxybenzoate
CAS No.:156001-68-2
Molecular Formula:C9H7NO3
Molecular Weight:177.159
Hs Code.:2926909090
European Community (EC) Number:809-169-2
DSSTox Substance ID:DTXSID20472104
Nikkaji Number:J3.412.674G
Wikidata:Q82300886
Mol file:156001-68-2.mol

Synonyms:methyl 3-cyano-4-hydroxybenzoate;156001-68-2;Methyl 3-cyano-4-hydroxy-benzoate;3-Cyano-4-hydroxybenzoic acid methyl ester;Benzoic acid, 3-cyano-4-hydroxy-, methyl ester;3-Cyano-4-hydroxy-benzoic acid methyl ester;Methyl3-cyano-4-hydroxybenzoate;methyl-3-cyano-4-hydroxybenzoate;2-Hydroxy-5-methoxycarbonyl-benzonitrile;SCHEMBL399625;DTXSID20472104;AHPCEMBOTQXADD-UHFFFAOYSA-N;EX-A3118;MFCD13248596;AKOS015891390;SB33920;DS-15564;SY015670;AM20030056;CS-0033761;FT-0755469;Methyl 3-cyano-4-hydroxy-benzoate, AldrichCPR;W-205796;Methyl 3-Cyano-4-hydroxybenzoate

Suppliers and Price of Methyl 3-cyano-4-hydroxybenzoate

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

TRC
methyl3-cyano-4-hydroxybenzoate
100mg
$ 155.00

J&W Pharmlab
Methyl3-cyano-4-hydroxy-benzoate 96%
1g
$ 265.00

Crysdot
Methyl3-cyano-4-hydroxybenzoate 98%
1g
$ 274.00

ChemScene
3-Cyano-4-hydroxybenzoicacidmethylester 98.11%
250mg
$ 96.00

ChemScene
3-Cyano-4-hydroxybenzoicacidmethylester 98.11%
1g
$ 242.00

ChemScene
3-Cyano-4-hydroxybenzoicacidmethylester 98.11%
100mg
$ 59.00

Chemenu
methyl3-cyano-4-hydroxybenzoate 95+%
10g
$ 1477.00

Chemenu
methyl3-cyano-4-hydroxybenzoate 95+%
5g
$ 888.00

Chemenu
methyl3-cyano-4-hydroxybenzoate 95+%
1g
$ 281.00

Chemcia Scientific
3-Cyano-4-hydroxy-benzoicacidmethylester ＞95%
0.5 G
$ 190.00

Total 26 raw suppliers

Chemical Property of Methyl 3-cyano-4-hydroxybenzoate

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Melting Point:167-168 °C(Solv: methanol (67-56-1); water (7732-18-5))
Refractive Index:1.573
Boiling Point:336.305 °C at 760 mmHg
PKA:5.56±0.18(Predicted)
Flash Point:157.192 °C
PSA：70.32000
Density:1.328 g/cm³
LogP:1.05048
Storage Temp.:under inert gas (nitrogen or Argon) at 2-8°C
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:177.042593085
Heavy Atom Count:13
Complexity:243

Purity/Quality:

99%, ^*data from raw suppliers

methyl3-cyano-4-hydroxybenzoate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of Methyl 3-cyano-4-hydroxybenzoate

There total 14 articles about Methyl 3-cyano-4-hydroxybenzoate 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: 100.0%

: 15126-06-4
methyl 3-iodo-4-hydroxybenzoate

: 143-33-9,25596-52-5
sodium cyanide

: 544-92-3
copper(I) cyanide

: 156001-68-2
methyl 3-cyano-4-hydroxybenzoate

Guidance literature:: In DMF (N,N-dimethyl-formamide); at 105 ℃; for 18h;

Reference yield: 98.0%

: 156001-68-2
methyl 3-cyano-4-hydroxybenzoate

Guidance literature:

Reference yield: 87.0%

: (E)-methyl 4-hydroxy-3-((hydroxyimino)methyl)benzoate

: 156001-68-2
methyl 3-cyano-4-hydroxybenzoate

Guidance literature:: With di-isopropyl azodicarboxylate; triphenylphosphine; In dichloromethane; at 20 ℃; Inert atmosphere;
DOI:10.1021/jo502396u