4-Ethylphenethylamine - CAS 64353-29-3
Catalog: |
BB032445 |
Product Name: |
4-Ethylphenethylamine |
CAS: |
64353-29-3 |
Synonyms: |
2-(4-ethylphenyl)ethanamine |
IUPAC Name: | 2-(4-ethylphenyl)ethanamine |
Description: | 4-Ethylphenethylamine (CAS# 64353-29-3) is a useful research chemical. |
Molecular Weight: | 149.23 |
Molecular Formula: | C10H15N |
Canonical SMILES: | CCC1=CC=C(C=C1)CCN |
InChI: | InChI=1S/C10H15N/c1-2-9-3-5-10(6-4-9)7-8-11/h3-6H,2,7-8,11H2,1H3 |
InChI Key: | XLJAVPNHXCHBPU-UHFFFAOYSA-N |
Boiling Point: | 240-241 ℃ (lit.) |
Density: | 0.94 g/cm3 |
Appearance: | Colorless liquid |
MDL: | MFCD00079757 |
LogP: | 2.45050 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021054144-A1 | Method for producing cyclic imide compound, composition, and compound | 20190920 |
US-2021069288-A1 | Pcsk9 antagonist compounds | 20190830 |
WO-2019175436-A1 | Antiviral compounds and use thereof | 20180316 |
EP-3765454-A1 | Antiviral compounds and use thereof | 20180316 |
US-2021070737-A1 | Antiviral compounds and use thereof | 20180316 |
PMID | Publication Date | Title | Journal |
18602830 | 20080801 | Structure-activity correlations for beta-phenethylamines at human trace amine receptor 1 | Bioorganic & medicinal chemistry |
Complexity: | 93 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 149.120449483 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 149.120449483 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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