9-Aminophenanthrene - CAS 947-73-9
Catalog: |
BB041498 |
Product Name: |
9-Aminophenanthrene |
CAS: |
947-73-9 |
Synonyms: |
phenanthren-9-amine |
IUPAC Name: | phenanthren-9-amine |
Description: | 9-Aminophenanthrene (CAS# 947-73-9 ) is a useful research chemical. |
Molecular Weight: | 193.24 |
Molecular Formula: | C14H11N |
Canonical SMILES: | C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)N |
InChI: | InChI=1S/C14H11N/c15-14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9H,15H2 |
InChI Key: | KIHQWOBUUIPWAN-UHFFFAOYSA-N |
Boiling Point: | 408.2 °C at 760 mmHg |
Melting Point: | 137-139 °C(lit.) |
Purity: | 95 % |
Density: | 1.208 g/cm3 |
Appearance: | White to brown powder |
Storage: | Keep in dark place, Inert atmosphere, Room temperature |
MDL: | MFCD00001177 |
LogP: | 4.15640 |
Vapor Pressure: | 0.00000405 [mmHg] |
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 |
WO-2021142281-A1 | Ligands for transition metal catalysts | 20200108 |
WO-2021142289-A1 | Complexes of n-heterocyclic carbenes for transition metal catalysis | 20200108 |
CN-112239424-A | Preparation method of aristolochia alkaloids and intermediate thereof | 20191218 |
CN-112239425-A | Preparation method of aporphine alkaloid and intermediate thereof | 20191218 |
US-2021098704-A1 | Compound for organic optoelectronic device, composition for organic optoelectronic device, organic optoelectronic device and display device | 20190930 |
PMID | Publication Date | Title | Journal |
28186253 | 20170501 | Mechanistic Investigations Into the Developmental Toxicity of Nitrated and Heterocyclic PAHs | Toxicological sciences : an official journal of the Society of Toxicology |
19084484 | 20090115 | Purification human PON1Q192 and PON1R192 isoenzymes by hydrophobic interaction chromatography and investigation of the inhibition by metals | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences |
17256854 | 20070221 | Dissecting the thermodynamics and cooperativity of ligand binding in cytochrome P450eryF | Journal of the American Chemical Society |
16460014 | 20060214 | NMR studies of ligand binding to P450(eryF) provides insight into the mechanism of cooperativity | Biochemistry |
16277314 | 20050930 | Different behavior of nitrenes and carbenes on photolysis and thermolysis: formation of azirine, ylidic cumulene, and cyclic ketenimine and the rearrangement of 6-phenanthridylcarbene to 9-phenanthrylnitrene | The Journal of organic chemistry |
Complexity: | 225 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.089149355 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.089149355 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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