3-Fluorophenethylamine - CAS 404-70-6
Catalog: |
BB024513 |
Product Name: |
3-Fluorophenethylamine |
CAS: |
404-70-6 |
Synonyms: |
2-(3-fluorophenyl)ethanamine |
IUPAC Name: | 2-(3-fluorophenyl)ethanamine |
Description: | 3-Fluorophenethylamine (CAS# 404-70-6) is a useful research chemical. |
Molecular Weight: | 139.17 |
Molecular Formula: | C8H10FN |
Canonical SMILES: | C1=CC(=CC(=C1)F)CCN |
InChI: | InChI=1S/C8H10FN/c9-8-3-1-2-7(6-8)4-5-10/h1-3,6H,4-5,10H2 |
InChI Key: | AUCVZEYHEFAWHO-UHFFFAOYSA-N |
Boiling Point: | 87 °C (15 mmHg) |
Purity: | 98 % |
Density: | 1.066 g/cm3 |
Appearance: | Colorless liquid |
MDL: | MFCD00075376 |
LogP: | 2.02720 |
GHS Hazard Statement: | H290 (11.54%): May be corrosive to metals [Warning Corrosive to Metals] |
Precautionary Statement: | P234, P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P390, P404, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113461631-A | 1,3, 4-oxadiazole neuraminidase inhibitor and preparation method and application thereof | 20210629 |
CN-112079732-A | Synthetic route of 4-alkyl secondary amino-2-butanol compound | 20200922 |
CN-112079732-B | Synthetic route of 4-alkyl secondary amino-2-butanol compound | 20200922 |
WO-2021212039-A1 | Inhibitors of cysteine proteases and methods of use thereof | 20200417 |
CN-113437227-A | Light-emitting film, preparation method and electroluminescent device | 20200323 |
PMID | Publication Date | Title | Journal |
18602830 | 20080801 | Structure-activity correlations for beta-phenethylamines at human trace amine receptor 1 | Bioorganic & medicinal chemistry |
Complexity: | 95.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 139.079727485 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 139.079727485 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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