(R)-1,2,3,4-Tetrahydroisoquinoline-1-carboxylic Acid - CAS 151004-93-2
Catalog: |
BB010597 |
Product Name: |
(R)-1,2,3,4-Tetrahydroisoquinoline-1-carboxylic Acid |
CAS: |
151004-93-2 |
Synonyms: |
(1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid; (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid |
IUPAC Name: | (1R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid |
Description: | (R)-1,2,3,4-Tetrahydroisoquinoline-1-carboxylic Acid (CAS# 151004-93-2) is a useful research chemical. |
Molecular Weight: | 177.20 |
Molecular Formula: | C10H11NO2 |
Canonical SMILES: | C1CNC(C2=CC=CC=C21)C(=O)O |
InChI: | InChI=1S/C10H11NO2/c12-10(13)9-8-4-2-1-3-7(8)5-6-11-9/h1-4,9,11H,5-6H2,(H,12,13)/t9-/m1/s1 |
InChI Key: | OXFGRWIKQDSSLY-SECBINFHSA-N |
Boiling Point: | 370.7 °C at 760 mmHg |
Density: | 1.225 g/cm3 |
LogP: | 1.28680 |
Publication Number | Title | Priority Date |
CN-112480001-A | Method and composition for preparing levo-praziquantel chiral intermediate | 20190911 |
CN-112481344-A | Preparation method of (R) -1,2,3, 4-tetrahydroisoquinoline-1-carboxylic acid and derivatives thereof | 20190911 |
WO-2021047565-A1 | Method for preparing (r)-praziquantel and chiral intermediate thereof, and composition | 20190911 |
WO-2021047566-A1 | Preparation method for (r)-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid, derivative thereof and levo-praziquantel | 20190911 |
CN-112442523-A | Method for preparing (R) -1,2,3, 4-tetrahydroisoquinoline-1-formic acid and derivatives thereof by enzymatic resolution | 20190827 |
Complexity: | 205 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.078978594 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.078978594 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 49.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.2 |
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Quinoline/Isoquinoline
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