Cas no 79594-24-4 (1-(adamantan-1-yl)-2-methylpropan-2-amine)
1-(Adamantan-1-yl)-2-methylpropan-2-amine is a structurally unique organic compound featuring an adamantane core linked to a branched alkylamine moiety. This configuration imparts notable stability and lipophilicity, making it a valuable intermediate in pharmaceutical and agrochemical synthesis. The adamantane group enhances rigidity and metabolic resistance, while the tertiary amine functionality offers reactivity for further derivatization. Its balanced physicochemical properties suggest potential applications in drug development, particularly for CNS-targeting agents due to its ability to cross the blood-brain barrier. The compound's well-defined stereochemistry and high purity also make it suitable for mechanistic studies and structure-activity relationship investigations.
79594-24-4 structure
Product Name:1-(adamantan-1-yl)-2-methylpropan-2-amine
1-(adamantan-1-yl)-2-methylpropan-2-amine Chemical and Physical Properties
Names and Identifiers
-
- Tricyclo[3.3.1.13,7]decane-1-ethanamine,a,a-dimethyl-
- 1-(1-adamantyl)-2-methylpropan-2-amine
- (adamant-1-ylmethyl)isopropylamine
- 1-(1-adamantyl)-2-methylpropan-2-amine(SALTDATA: HCl 0.33H2O)
- somantadine
- Somantadine [INN]
- UNII-02WMX1FS9Y
- 1-(adamantan-1-yl)-2-methylpropan-2-amine
- CHEMBL2111145
- Tetraiodo-2-sulfobenzoicAnhydride
- 1-(1-Adamantyl)-2-methylpropan-2-amine, AldrichCPR
- Q27231551
- 79594-24-4
- DTXSID101000612
- 02WMX1FS9Y
- .BETA.-(1-ADAMANTYL)-.ALPHA.,.ALPHA.-DIMETHYLETHYLAMINE
- EN300-1859247
- AKOS004119591
- TRICYCLO(3.3.1. SUP(3,7)) DECANE-1-ETHANAMINE, .ALPHA.,.ALPHA.-DIMETHYL-
- SCHEMBL599034
- .ALPHA.,.ALPHA.-DIMETHYL-1-ADAMANTANEETHYLAMINE
- CS-0273046
- α,α-Dimethyltricyclo[3.3.1.13,7]decane-1-ethanamine (ACI)
- β-(1-Adamantyl)-α,α-dimethylethylamine
-
- MDL： MFCD03106117
- Inchi： 1S/C14H25N/c1-13(2,15)9-14-6-10-3-11(7-14)5-12(4-10)8-14/h10-12H,3-9,15H2,1-2H3
- InChI Key： OWKXRDQRMTVCEX-UHFFFAOYSA-N
- SMILES： NC(CC12CC3CC(C1)CC(C3)C2)(C)C
Computed Properties
- Exact Mass: 207.19900
- Monoisotopic Mass: 207.198699802g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 225
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.7
- Topological Polar Surface Area: 26?2
Experimental Properties
- Density: 1.5±0.1 g/cm3
- Boiling Point: 274.6±15.0 °C at 760 mmHg
- Flash Point: 119.9±20.4 °C
- Refractive Index: 1.528
- PSA: 26.02000
- LogP: 4.03050
- Vapor Pressure: 0.0±0.6 mmHg at 25°C
1-(adamantan-1-yl)-2-methylpropan-2-amine Security Information
- Signal Word：warning
- Hazard Statement： H303May be harmful if swallowed+H313Skin contact may be harmful+H333Inhalation may be harmful to the body
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Safety Instruction： H303+H313+H333
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
1-(adamantan-1-yl)-2-methylpropan-2-amine Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| A2B Chem LLC | AH52349-10mg |
Somantadine |
79594-24-4 | 95% | 10mg |
$73.00 | 2024-04-19 | |
| A2B Chem LLC | AH52349-25mg |
Somantadine |
79594-24-4 | 95% | 25mg |
$101.00 | 2024-04-19 | |
| A2B Chem LLC | AH52349-50mg |
Somantadine |
79594-24-4 | 95% | 50mg |
$127.00 | 2024-04-19 | |
| Chemenu | CM602137-50mg |
Somantadine |
79594-24-4 | 95%+ | 50mg |
$2772 | 2024-07-23 | |
| Chemenu | CM602137-100mg |
Somantadine |
79594-24-4 | 95%+ | 100mg |
$2904 | 2024-07-23 | |
| Chemenu | CM602137-250mg |
Somantadine |
79594-24-4 | 95%+ | 250mg |
$3036 | 2024-07-23 | |
| Chemenu | CM602137-500mg |
Somantadine |
79594-24-4 | 95%+ | 500mg |
$3168 | 2024-07-23 | |
| Chemenu | CM602137-1g |
Somantadine |
79594-24-4 | 95%+ | 1g |
$3300 | 2024-07-23 | |
| Enamine | EN300-1859247-0.05g |
1-(adamantan-1-yl)-2-methylpropan-2-amine |
79594-24-4 | 0.05g |
$924.0 | 2023-09-18 | ||
| Enamine | EN300-1859247-0.1g |
1-(adamantan-1-yl)-2-methylpropan-2-amine |
79594-24-4 | 0.1g |
$968.0 | 2023-09-18 |
1-(adamantan-1-yl)-2-methylpropan-2-amine Related Literature
-
Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
-
Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
-
P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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