2-(4-Chlorophenyl)ethylamine - CAS 156-41-2
Catalog: |
BB011218 |
Product Name: |
2-(4-Chlorophenyl)ethylamine |
CAS: |
156-41-2 |
Synonyms: |
2-(4-chlorophenyl)ethanamine |
IUPAC Name: | 2-(4-chlorophenyl)ethanamine |
Description: | 2-(4-Chlorophenyl)ethylamine has been used as a reactant in the preparation of isoalloxazine derivatives as cholinesterase inhibitors with a potential use in Alzheimer therapy. |
Molecular Weight: | 155.62 |
Molecular Formula: | C8H10ClN |
Canonical SMILES: | C1=CC(=CC=C1CCN)Cl |
InChI: | InChI=1S/C8H10ClN/c9-8-3-1-7(2-4-8)5-6-10/h1-4H,5-6,10H2 |
InChI Key: | SRXFXCKTIGELTI-UHFFFAOYSA-N |
Boiling Point: | 242-245 °C |
Purity: | 97 % |
Density: | 1.112 g/cm3 |
Appearance: | Dark solid |
Storage: | Store Cold |
MDL: | MFCD00008191 |
LogP: | 2.54150 |
GHS Hazard Statement: | H315 (97.62%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (95.24%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
20688518 | 20100901 | S-benzylisothiourea derivatives as small-molecule inhibitors of indoleamine-2,3-dioxygenase | Bioorganic & medicinal chemistry letters |
18602830 | 20080801 | Structure-activity correlations for beta-phenethylamines at human trace amine receptor 1 | Bioorganic & medicinal chemistry |
16309833 | 20060109 | Mitochondrial damage induced by fetal hyperphenylalaninemia in the rat brain and liver: its prevention by melatonin, Vitamin E, and Vitamin C | Neuroscience letters |
16133137 | 20051101 | Harmane inhibits serotonergic dorsal raphe neurons in the rat | Psychopharmacology |
6130710 | 19830101 | Neuropharmacology of the parasitic trematode, Schistosoma mansoni | The American journal of tropical medicine and hygiene |
Complexity: | 87.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 155.050177 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 155.050177 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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