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| CAS No.: | 935-56-8 |
|---|---|
| Name: | 1-Chloroadamantane |
| Article Data: | 165 |
| Molecular Structure: | |
|
|
|
| Formula: | C10H15Cl |
| Molecular Weight: | 170.682 |
| Synonyms: | Adamantane,1-chloro- (6CI,7CI,8CI);1-Adamantyl chloride;3-Chloroadamantane;Adamantyl chloride;Tricyclo[3.3.1.13,7]decane,1-chloro-; |
| EINECS: | 213-305-0 |
| Density: | 1.12 g/cm3 |
| Melting Point: | 163-166 °C |
| Boiling Point: | 232.8 °C at 760 mmHg |
| Flash Point: | 82.3 °C |
| Solubility: | Poorly soluble in water. Soluble in hydrocarbons. But readily soluble in nonpolar organic solvents. |
| Appearance: | white to light grey adhering crystalline solid |
| Hazard Symbols: |
|
| Risk Codes: | 36/37/38 |
| Safety: | 24/25 |
| PSA: | 0.00000 |
| LogP: | 3.19400 |
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Chemistry
IUPAC Name: 1-Chloroadamantane
Synonyms of 1-Chloroadamantane (CAS NO.935-56-8): 1-Adamantyl chloride ; Adamantyl chloride ; Tricyclo(3.3.1.1(3,7))decane, 1-chloro- ; 1-Chlorotricyclo(3.3.1.13,7)decane ; Adamantane, 1-chloro- (8CI)
CAS NO: 935-56-8
Molecular Formula: C10H15Cl
Molecular Weight: 170.68
Molecular Structure: 
EINECS: 213-305-0
H bond acceptors: 0
H bond donors: 0
Freely Rotating Bonds: 0
Polar Surface Area: 0 Å2
Index of Refraction: 1.533
Molar Refractivity: 46.99 cm3
Molar Volume: 151.3 cm3
Surface Tension: 36 dyne/cm
Density: 1.12 g/cm3
Flash Point: 82.3 °C
Enthalpy of Vaporization: 45.04 kJ/mol
Boiling Point: 232.8 °C at 760 mmHg
Vapour Pressure: 0.088 mmHg at 25°C
Melting point: 163-166 °C
Appearance: white to light grey adhering crystalline solid
Product Categories of 1-Chloroadamantane (CAS NO.935-56-8): Adamantane derivatives;Adamantanes;Alkyl;Halogenated Hydrocarbons;Organic Building Blocks
SMILES: ClC13CC2CC(CC(C1)C2)C3
InChI: InChI=1/C10H15Cl/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6H2
InChIKey: OZNXTQSXSHODFR-UHFFFAOYAS
Std. InChI: InChI=1S/C10H15Cl/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6H2
Std. InChIKey: OZNXTQSXSHODFR-UHFFFAOYSA-N
Safety Profile
Safety Information about 1-Chloroadamantane (CAS NO.935-56-8):
Hazard Codes: 
Xi
Risk Statements: 36/37/38
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 24/25
S24/25: Avoid contact with skin and eyes.
WGK Germany: 3
Specification
General Information: As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media: Use agent most appropriate to extinguish fire.
Handling: Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Avoid contact with eyes, skin, and clothing. Avoid ingestion and inhalation.
Storage: Store in a cool, dry place. Keep container closed when not in use.