5,6,7,8-Tetrahydroisoquinoline - CAS 36556-06-6
Catalog: |
BB022999 |
Product Name: |
5,6,7,8-Tetrahydroisoquinoline |
CAS: |
36556-06-6 |
Synonyms: |
5,6,7,8-tetrahydroisoquinoline |
IUPAC Name: | 5,6,7,8-tetrahydroisoquinoline |
Description: | 5,6,7,8-Tetrahydroisoquinoline (CAS# 36556-06-6) is a useful research chemical. |
Molecular Weight: | 133.19 |
Molecular Formula: | C9H11N |
Canonical SMILES: | C1CCC2=C(C1)C=CN=C2 |
InChI: | InChI=1S/C9H11N/c1-2-4-9-7-10-6-5-8(9)3-1/h5-7H,1-4H2 |
InChI Key: | HTMGQIXFZMZZKD-UHFFFAOYSA-N |
Boiling Point: | 106-108 °C |
Purity: | 95 % |
Density: | 1.03 g/cm3 |
MDL: | MFCD00012168 |
LogP: | 1.96040 |
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 |
CN-113354637-A | Compounds targeting androgen receptor | 20210413 |
CN-113072548-A | Method for preparing 5, 8-dihydro-6H-isoquinoline [3, 2-alpha ] isoquinoline based on micro-reaction system | 20210319 |
CN-112521295-B | Long-acting low-addiction compound and preparation method thereof | 20200831 |
CN-112521357-B | Long-acting low-addiction HNK derivative and preparation method thereof | 20200831 |
CN-112521358-B | Application of long-acting low-addiction HNK derivative in preparation of medicines | 20200831 |
PMID | Publication Date | Title | Journal |
16310796 | 20060127 | Capillary liquid chromatography-tandem mass spectrometry of tetrahydroisoquinoline derived neurotoxins: a study on the blood-brain barrier of rat brain | Journal of chromatography. A |
Complexity: | 111 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 133.089149355 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 133.089149355 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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Quinoline/Isoquinoline
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