Methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate

Base Information Edit

Chemical Name:Methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate
CAS No.:79815-19-3
Molecular Formula:C11H13 N O2
Molecular Weight:191.23
Hs Code.:
European Community (EC) Number:851-859-0
ChEMBL ID:CHEMBL273939
DSSTox Substance ID:DTXSID501000757
Nikkaji Number:J1.120.263B
Mol file:79815-19-3.mol

Synonyms:methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate;57060-86-3;1,2,3,4-Tetrahydro-isoquinoline-3-carboxylic acid methyl ester;79815-19-3;methyl 1,2,3,4-tetrahydro-isoquinoline-3-carboxylate;CHEMBL273939;MFCD03981003;Enamine_005288;SCHEMBL1491698;YTNGWXICCHJHKA-UHFFFAOYSA-N;DTXSID501000757;HMS1409A08;BDBM50023456;AKOS000118713;AKOS016118136;AB14455;AB16887;AB27613;AS-47532;SY282364;FT-0640433;FT-0651361;FT-0695124;FT-0695125;EN300-05093;F14149;3-Methoxycarbonyl-1,2,3,4-tetrahydroisoquinoline;J-521737;3-(RS) carbomethoxy 1,2,3,4-tetrahydro isoquinoline;Z56910468;METHYL 1,2,3,4-TETRAHYDRO-3-ISOQUINOLINECARBOXYLATE;1,2,3,4-TETRAHYDRO-3-ISOQUINOLINECARBOXYLIC ACID METHYL ESTER;Methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate (H-DL-Tic-OMe)

Suppliers and Price of Methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate

Supply Marketing:Edit

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

AHH
1,2,3,4-Tetrahydro-isoquinoline-3-carboxylicacidmethylester 98%
5g
$ 285.00

Total 3 raw suppliers

Chemical Property of Methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate Edit

Chemical Property:

Melting Point:262 - 264 °C (diethyl ether)
PSA：38.33000
LogP:1.20270
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:191.094628657
Heavy Atom Count:14
Complexity:217

Purity/Quality:

99%min ^*data from raw suppliers

1,2,3,4-Tetrahydro-isoquinoline-3-carboxylicacidmethylester 98% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC(=O)C1CC2=CC=CC=C2CN1

Technology Process of Methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate

There total 10 articles about Methyl 1,2,3,4-tetrahydroisoquinoline-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%

: 67-56-1
methanol

: 74163-81-8
L-Tic-OH

: 79815-19-3,79799-05-6
methyl (3S)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylate

Guidance literature:: With thionyl chloride;
DOI:10.3987/COM-05-10571

Reference yield: 100.0%

: 252008-94-9,189563-75-5
methyl (3S)-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylate

: 79815-19-3,79799-05-6
methyl (3S)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylate

Guidance literature:: methyl (3S)-2-(tert-butoxycarbonyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylate; With trifluoroacetic acid; In dichloromethane; at 20 ℃; for 1h;

With N-ethyl-N,N-diisopropylamine; In dichloromethane; at 20 ℃; for 0.25h;
DOI:10.1016/S0040-4039(01)01526-X