1-Adamantanemethylamine - CAS 17768-41-1
Catalog: |
BB013322 |
Product Name: |
1-Adamantanemethylamine |
CAS: |
17768-41-1 |
Synonyms: |
1-adamantylmethanamine |
IUPAC Name: | 1-adamantylmethanamine |
Description: | 1-Adamantanemethylamine (CAS# 17768-41-1) is a useful intermediate for the synthesis of adamantyl-substituted thiazolidinones with anti-HIV activity. |
Molecular Weight: | 165.28 |
Molecular Formula: | C11H19N |
Canonical SMILES: | C1C2CC3CC1CC(C2)(C3)CN |
InChI: | InChI=1S/C11H19N/c12-7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10H,1-7,12H2 |
InChI Key: | XSOHXMFFSKTSIT-UHFFFAOYSA-N |
Boiling Point: | 229.4 °C at 760 mmHg |
Density: | 1.039 g/cm3 |
MDL: | MFCD00074750 |
LogP: | 2.86180 |
GHS Hazard Statement: | H314 (97.5%): 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 |
CN-111650310-A | Method for determining residual quantity of ribavirin and amantadine compounds in poultry food | 20200420 |
CN-113372327-A | Glutarimide skeleton-based compound and application thereof | 20200225 |
WO-2021170021-A1 | Glutarimide skeleton-based compounds and application thereof | 20200225 |
US-2021115038-A1 | Malic enzyme inhibitors | 20191017 |
WO-2021074898-A1 | Malic enzyme inhibitors | 20191017 |
PMID | Publication Date | Title | Journal |
20379555 | 20100414 | An extended cavitand with an introverted carboxylic acid | Chemical communications (Cambridge, England) |
21578064 | 20091003 | cis-Bis[(1-adamantylmeth-yl)amine-κN]-dichloridoplatinum(II) N,N-dimethyl-formamide solvate | Acta crystallographica. Section E, Structure reports online |
16161183 | 20060501 | Simultaneous liquid chromatographic assay of amantadine and its four related compounds in phosphate-buffered saline using 4-fluoro-7-nitro-2,1,3-benzoxadiazole as a fluorescent derivatization reagent | Biomedical chromatography : BMC |
5091970 | 19710601 | Antiviral agents. 2. Structure-activity relationships of compounds related to 1-adamantanamine | Journal of medicinal chemistry |
Complexity: | 156 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 165.151749610 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.151749610 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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