Methyl isoquinoline-3-carboxylate

Base Information

Chemical Name:Methyl isoquinoline-3-carboxylate
CAS No.:27104-73-0
Molecular Formula:C11H9NO2
Molecular Weight:187.198
Hs Code.:29334900
European Community (EC) Number:626-565-9
UNII:EQT2546QNR
DSSTox Substance ID:DTXSID10352385
Nikkaji Number:J1.192.406I
Wikidata:Q72492287
ChEMBL ID:CHEMBL416152
Mol file:27104-73-0.mol

Synonyms:methyl isoquinoline-3-carboxylate;27104-73-0;Methyl 3-isoquinolinecarboxylate;3-Isoquinolinecarboxylic acid, methyl ester;Isoquinoline-3-carboxylic acid methyl ester;EQT2546QNR;UNII-EQT2546QNR;CHEMBL-416152;MFCD00075138;Maybridge1_001945;D0R2HJ;Bis(2-Pyrrolidinoethyl)ether;SCHEMBL214090;CHEMBL416152;HMS547A09;DTXSID10352385;CHEBI:183729;methyl isoquinoline-3-carbo-xylate;BCP05782;BBL037033;CCG-50796;STL560143;AKOS015851535;AC-7697;CS-W016858;Methyl 3-isoquinolinecarboxylate, 98%;METHYL-3-ISOQUINOLINECARBOXYLATE;PS-4179;SDCCGMLS-0065873.P001;3-Isoquinolinecarboxylic acid methyl ester;SY018429;A5289;AM20051023;FT-0628748;J-200107;SR-01000640142-1

Suppliers and Price of Methyl isoquinoline-3-carboxylate

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
MethylIsoquinoline-3-carboxylate
10mg
$ 45.00

SynQuest Laboratories
Methyl isoquinoline-3-carboxylate
5 g
$ 157.00

Sigma-Aldrich
Methyl 3-isoquinolinecarboxylate 98%
1g
$ 50.60

Matrix Scientific
Methyl isoquinoline-3-carboxylate 97%
1g
$ 83.00

Matrix Scientific
Methyl isoquinoline-3-carboxylate 97%
10g
$ 588.00

Labseeker
Methylisoquinoline-3-carboxylate 95
500g
$ 2567.00

Frontier Specialty Chemicals
Methyl 3-isoquinolinecarboxylate
5g
$ 207.00

Frontier Specialty Chemicals
Methyl 3-isoquinolinecarboxylate
1g
$ 52.00

Frontier Specialty Chemicals
Methyl 3-isoquinolinecarboxylate
250mg
$ 16.00

Crysdot
Methylisoquinoline-3-carboxylate 97%
10g
$ 204.00

Total 54 raw suppliers

Chemical Property of Methyl isoquinoline-3-carboxylate

Chemical Property:

Appearance/Colour:Cream powder
Vapor Pressure:6.5E-05mmHg at 25°C
Melting Point:84-88 ºC
Refractive Index:1.614
Boiling Point:344.6 °Cat760mmHg
PKA:2.58±0.30(Predicted)
Flash Point:162.2 °C
PSA：39.19000
Density:1.21 g/cm³
LogP:2.02140
Storage Temp.:Sealed in dry,Room Temperature
XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:187.063328530
Heavy Atom Count:14
Complexity:217

Purity/Quality:

99%, ^*data from raw suppliers

MethylIsoquinoline-3-carboxylate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-37/39

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1=CC2=CC=CC=C2C=N1
Uses Methyl 3-isoquinolinecarboxylate was used in the preparation of 3-acetylisoquinoline.

Technology Process of Methyl isoquinoline-3-carboxylate

There total 25 articles about Methyl isoquinoline-3-carboxylate 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%