2-tert-butyl 6-methyl 3,4-dihydroisoquinoline-2,6(1H)-dicarboxylate

Base Information

Chemical Name:2-tert-butyl 6-methyl 3,4-dihydroisoquinoline-2,6(1H)-dicarboxylate
CAS No.:170097-66-2
Molecular Formula:C16H21 N O4
Molecular Weight:291.34
Hs Code.:2933499090
DSSTox Substance ID:DTXSID00467376
Mol file:170097-66-2.mol

Synonyms:170097-66-2;2-tert-butyl 6-methyl 3,4-dihydroisoquinoline-2,6(1H)-dicarboxylate;METHYL 2-BOC-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-6-CARBOXYLATE;2-O-tert-butyl 6-O-methyl 3,4-dihydro-1H-isoquinoline-2,6-dicarboxylate;3,4-DIHYDRO-1H-ISOQUINOLINE-2,6-DICARBOXYLIC ACID 2-TERT-BUTYL ESTER 6-METHYL ESTER;MFCD08275038;PENHSKQWTCPDFD-UHFFFAOYSA-N;SCHEMBL3024823;DTXSID00467376;AKOS015840969;CS-W018407;PB22140;3,4-Dihydro-1H-isoquinoline-2.6-dicarboxylic acid 2-tert-butyl ester-6-methyl ester;AM803315;AS-39530;SY123741;FT-0643629;(S)-(+)-2-AMINO-4-BROMOBUTYRICACIDMETHYLESTER;6-Methyl 2-boc-3,4-dihydroisoquinoline-6(1H)-carboxylate;2-tert-butyl6-methyl3,4-dihydroisoquinoline-2,6(1H)-dicarboxylate;2-tert-Butoxycarbonyl-6-methoxycarbonyl-1,2,3,4-tetrahydroisoquinoline;2-tert-butyl 6-methyl 1,2,3,4-tetrahydroisoquinoline-2,6-dicarboxylate;2-(1,1-dimethylethyl) 6-methyl 3,4-dihydro-2,6(1H)-isoquinoline-dicarboxylate;3,4-dihydro(1H)isoquinoline-2,6-dicarboxylic acid 2-(tert-butyl) ester 6-methyl ester;tert-Butyl 6-(methoxycarbonyl)-1,2,3,4-tetrahydroisoquinoline-2-carboxylate

Suppliers and Price of 2-tert-butyl 6-methyl 3,4-dihydroisoquinoline-2,6(1H)-dicarboxylate

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
Methyl2-Boc-1,2,3,4-tetrahydro-isoquinoline-6-carboxylate
10mg
$ 85.00

Matrix Scientific
Methyl2-Boc-1,2,3,4-tetrahydro-isoquinoline-6-carboxylate 95+%
1g
$ 1090.00

J&W Pharmlab
3,4-Dihydro-1H-isoquinoline-2,6-dicarboxylicacid2-tert-butylester6-methylester 96%
100mg
$ 137.00

Crysdot
2-tert-Butyl6-methyl3,4-dihydroisoquinoline-2,6(1H)-dicarboxylate 95+%
1g
$ 468.00

Crysdot
2-tert-Butyl6-methyl3,4-dihydroisoquinoline-2,6(1H)-dicarboxylate 95+%
5g
$ 1409.00

Chemenu
Methyl2-Boc-1,2,3,4-tetrahydro-isoquinoline-6-carboxylate 95%
5g
$ 1328.00

Chemenu
Methyl2-Boc-1,2,3,4-tetrahydro-isoquinoline-6-carboxylate 95%
1g
$ 442.00

American Custom Chemicals Corporation
2-TERT-BUTYL 6-METHYL 3,4-DIHYDROISOQUINOLINE-2,6(1H)-DICARBOXYLATE 97.00%
1G
$ 1928.85

Alichem
2-tert-Butyl6-methyl3,4-dihydroisoquinoline-2,6(1H)-dicarboxylate
250mg
$ 181.44

Alichem
2-tert-Butyl6-methyl3,4-dihydroisoquinoline-2,6(1H)-dicarboxylate
5g
$ 1455.30

Total 22 raw suppliers

Chemical Property of 2-tert-butyl 6-methyl 3,4-dihydroisoquinoline-2,6(1H)-dicarboxylate

Chemical Property:

Vapor Pressure:4.97E-07mmHg at 25°C
Refractive Index:1.535
Boiling Point:413°C at 760 mmHg
PKA:-1.60±0.20(Predicted)
Flash Point:203.6°C
PSA：55.84000
Density:1.154g/cm³
LogP:2.70430
Storage Temp.:Keep in dark place,Sealed in dry,Room Temperature
XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:291.14705815
Heavy Atom Count:21
Complexity:402

Purity/Quality:

97% ^*data from raw suppliers

Methyl2-Boc-1,2,3,4-tetrahydro-isoquinoline-6-carboxylate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)N1CCC2=C(C1)C=CC(=C2)C(=O)OC
Uses Methyl 2-Boc-1,2,3,4-tetrahydro-isoquinoline-6-carboxylate is an intermediate used to prepare pyridyloxyacetyl tetrahydroisoquinoline compounds as NAMPT inhibitors useful in treating cancer.

Technology Process of 2-tert-butyl 6-methyl 3,4-dihydroisoquinoline-2,6(1H)-dicarboxylate

There total 16 articles about 2-tert-butyl 6-methyl 3,4-dihydroisoquinoline-2,6(1H)-dicarboxylate 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%

: 877861-62-6
methyl 1,2,3,4-tetrahydroisoquinoline-6-carboxylate hydrochloride

: 24424-99-5
di-tert-butyl dicarbonate

: 170097-66-2
3,4-Dihydro-1H-isoquinoline-2.6-dicarboxylic acid 2-tert-butyl ester-6-methyl ester

Guidance literature:: With triethylamine; In methanol; for 24h;

Reference yield: 90.0%

: 185057-00-5
methyl 1,2,3,4-tetrahydroisoquinoline-6-carboxylate

: 24424-99-5
di-tert-butyl dicarbonate

: 170097-66-2
3,4-Dihydro-1H-isoquinoline-2.6-dicarboxylic acid 2-tert-butyl ester-6-methyl ester

Guidance literature:: With triethylamine; In dichloromethane; at 20 ℃; for 6h;
DOI:10.1016/j.ejmech.2018.12.065

Reference yield: 81.4%

: 67-56-1
methanol

: 893566-74-0
6-bromo-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydroisoquinoline

: 201230-82-2
carbon monoxide

: 170097-66-2
3,4-Dihydro-1H-isoquinoline-2.6-dicarboxylic acid 2-tert-butyl ester-6-methyl ester

Guidance literature:: With (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; triethylamine; In acetonitrile; at 100 ℃; for 24h; under 16501.7 Torr; Autoclave;