Methyl 1,2,3,4-Tetrahydroisoquinoline-5-carboxylate Hydrochloride - CAS 1035700-06-1
Catalog: |
BB001177 |
Product Name: |
Methyl 1,2,3,4-Tetrahydroisoquinoline-5-carboxylate Hydrochloride |
CAS: |
1035700-06-1 |
Synonyms: |
1,2,3,4-tetrahydroisoquinoline-5-carboxylic acid methyl ester;hydrochloride; methyl 1,2,3,4-tetrahydroisoquinoline-5-carboxylate;hydrochloride |
IUPAC Name: | methyl 1,2,3,4-tetrahydroisoquinoline-5-carboxylate;hydrochloride |
Description: | Methyl 1,2,3,4-Tetrahydroisoquinoline-5-carboxylate Hydrochloride (CAS# 1035700-06-1) is a useful research chemical. |
Molecular Weight: | 227.69 |
Molecular Formula: | C11H14ClNO2 |
Canonical SMILES: | COC(=O)C1=C2CCNCC2=CC=C1.Cl |
InChI: | InChI=1S/C11H13NO2.ClH/c1-14-11(13)10-4-2-3-8-7-12-6-5-9(8)10;/h2-4,12H,5-7H2,1H3;1H |
InChI Key: | DTFQONPAXHKIBB-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 °C |
LogP: | 2.24970 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
EP-3194367-A1 | Tetrahydroisoquinoline derivatives and pharmaceutical compositions useful for the treatment of obesity and diabetes | 20140917 |
JP-2017528485-A | Tetrahydroisoquinoline derivatives and pharmaceutical compositions useful for the treatment of obesity and diabetes | 20140917 |
JP-6559228-B2 | Tetrahydroisoquinoline derivatives and pharmaceutical compositions useful for the treatment of obesity and diabetes | 20140917 |
US-2016075657-A1 | Tetrahydroisoquinoline derivatives, pharmaceutical compositions and uses thereof | 20140917 |
US-9340510-B2 | Tetrahydroisoquinoline derivatives, pharmaceutical compositions and uses thereof | 20140917 |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 227.0713064 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 227.0713064 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 38.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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