2-Amino-8-quinolinol - CAS 70125-16-5
Catalog: |
BB034078 |
Product Name: |
2-Amino-8-quinolinol |
CAS: |
70125-16-5 |
Synonyms: |
2-aminoquinolin-8-ol |
IUPAC Name: | 2-aminoquinolin-8-ol |
Description: | 2-Amino-8-quinolinol (CAS# 70125-16-5) is a compound useful in organic synthesis. |
Molecular Weight: | 160.17 |
Molecular Formula: | C9H8N2O |
Canonical SMILES: | C1=CC2=C(C(=C1)O)N=C(C=C2)N |
InChI: | InChI=1S/C9H8N2O/c10-8-5-4-6-2-1-3-7(12)9(6)11-8/h1-5,12H,(H2,10,11) |
InChI Key: | UFVLIVCXTIGACT-UHFFFAOYSA-N |
Boiling Point: | 385.3 °C at 760 mmHg |
Melting Point: | 157-160 °C |
Purity: | 95 % |
Density: | 1.363 g/cm3 |
Appearance: | Green-yellow solid |
MDL: | MFCD00168931 |
LogP: | 2.10380 |
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 |
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PMID | Publication Date | Title | Journal |
21584296 | 20110814 | Anhydrous mono- and dinuclear tris(quinolinolate) complexes of scandium: the missing structures of rare earth metal 8-quinolinolates | Dalton transactions (Cambridge, England : 2003) |
21189019 | 20110127 | Identifying chelators for metalloprotein inhibitors using a fragment-based approach | Journal of medicinal chemistry |
15481978 | 20041021 | Identification and specificity studies of small-molecule ligands for SH3 protein domains | Journal of medicinal chemistry |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 160.063662883 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 160.063662883 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 59.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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