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| CAS No.: | 38584-37-1 |
|---|---|
| Name: | 3-(Hydroxymethyl)-1-adamantol |
| Article Data: | 10 |
| Molecular Structure: | |
|
|
|
| Formula: | C11H18O2 |
| Molecular Weight: | 182.263 |
| Synonyms: | 1-Hydroxymethyl-3-adamantanol;3-(Hydroxymethyl)-1-adamantanol;3-Hydroxytricyclo[3.3.1.13,7]decane-1-methanol; |
| EINECS: | 622-732-5 |
| Density: | 1.261 g/cm3 |
| Melting Point: | 158-162 °C |
| Boiling Point: | 322.6 °C at 760 mmHg |
| Flash Point: | 156.5 °C |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 41 |
| Safety: | 26-39 |
| PSA: | 40.46000 |
| LogP: | 1.31000 |
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Chemistry
Molecular Structure of 3-(Hydroxymethyl)-1-adamantol (CAS NO.38584-37-1):
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Empirical Formula: C11H18O2
Molecular Weight: 182.2594
H bond acceptors: 2
H bond donors: 2
Freely Rotating Bonds: 3
Polar Surface Area: 40.46 Å2
Index of Refraction: 1.606
Molar Refractivity: 49.84 cm3
Molar Volume: 144.5 cm3
Surface Tension: 65.9 dyne/cm
Density: 1.261 g/cm3
Flash Point: 156.5 °C
Enthalpy of Vaporization: 65.42 kJ/mol
Boiling Point: 322.6 °C at 760 mmHg
Vapour Pressure: 2.2E-05 mmHg at 25°C
Melting point: 158-162 °C
SMILES: OCC12CC3CC(O)(C1)CC(C2)C3
InChI: InChI=1/C11H18O2/c12-7-10-2-8-1-9(3-10)5-11(13,4-8)6-10/h8-9,12-13H,1-7H2
Safety Profile
Hazard Codes: 
Xi
Risk Statements: 41
R41:Risk of serious damage to the eyes.
Safety Statements: 26-39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S39:Wear eye / face protection.
Specification
3-(Hydroxymethyl)-1-adamantol , with CAS number of 38584-37-1, can be called tricyclo[3.3.1.1~3,7~]decane-1-methanol, 3-hydroxy- ; 3-(Hydroxymethyl)adamantan-1-ol .