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Cas Database |
| Name |
Ethyl adamantane-1-carboxylate |
EINECS | 218-253-2 |
| CAS No. | 2094-73-7 | Density | 1.106 g/cm3 |
| PSA | 26.30000 | LogP | 2.76590 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C13H20O2 | Boiling Point | 261.8 °C at 760 mmHg |
| Molecular Weight | 208.301 | Flash Point | 109.9 °C |
| Transport Information | N/A | Appearance | white crystalline powder |
| Safety | 24/25 | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1-Adamantanecarboxylicacid, ethyl ester (6CI,7CI,8CI);1-Adamantylcarboxylic acid ethyl ester;1-Carbethoxyadamantane;Ethyl 1-adamantanecarboxylate;Tricyclo[3.3.1.13,7]decane-1-carboxylicacid, ethyl ester; |
Article Data | 25 |
Ethyl adamantane-1-carboxylate Chemical Properties
IUPAC Name: Ethyl adamantane-1-carboxylate
Molecular Structure: 
Molecular Formula: C13H20O2
Molecular Weight: 208.30
CAS NO: 2094-73-7
EINECS: 218-253-2
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 3
Polar Surface Area: 26.3 Å2
Index of Refraction: 1.524
Molar Refractivity: 57.7 cm3
Molar Volume: 188.3 cm3
Surface Tension: 41.4 dyne/cm
Density: 1.106 g/cm3
Flash Point: 109.9 °C
Enthalpy of Vaporization: 49.95 kJ/mol
Boiling Point: 261.8 °C at 760 mmHg
Vapour Pressure: 0.0113 mmHg at 25°C
Product Categories of Ethyl adamantane-1-carboxylate (CAS NO.2094-73-7): Adamantane derivatives;Organic acids;Adamantanes
Synonyms: Ethyl tricyclo(3.3.1.13,7)decane-1-carboxylate
SMILES: O=C(OCC)C13CC2CC(CC(C1)C2)C3
InChI: InChI=1/C13H20O2/c1-2-15-12(14)13-6-9-3-10(7-13)5-11(4-9)8-13/h9-11H,2-8H2,1H3
InChIKey: SYEXGNJRYPOUSI-UHFFFAOYAU
Std. InChI: InChI=1S/C13H20O2/c1-2-15-12(14)13-6-9-3-10(7-13)5-11(4-9)8-13/h9-11H,2-8H2,1H3
Std. InChIKey: SYEXGNJRYPOUSI-UHFFFAOYSA-N
Ethyl adamantane-1-carboxylate Safety Profile
Safety Information about Ethyl adamantane-1-carboxylate (CAS NO.2094-73-7):
Safety Statements: 24/25
S24/25:Avoid contact with skin and eyes.
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