5-CHLORO-2-ADAMANTANONE

IUPAC Name: 5-Chloroadamantan-2-one
Molecular Structure:
Molecular Formula: C₁₀H₁₃ClO
Molecular Weight: 184.66
CAS NO: 20098-17-3
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 0
Polar Surface Area: 17.07 Å²
Index of Refraction: 1.546
Molar Refractivity: 47.1 cm³
Molar Volume: 148.5 cm³
Surface Tension: 41.1 dyne/cm
Density: 1.24 g/cm³
Flash Point: 140.7 °C
Enthalpy of Vaporization: 52.84 kJ/mol
Boiling Point: 289.1 °C at 760 mmHg
Vapour Pressure: 0.00225 mmHg at 25 begin_of_the_skype_highlighting 00225 mmHg at 25 免费  end_of_the_skype_highlighting°C 
Melting Point: 200 °C
Product Categories 5-Chloro-2-adamantanone (CAS NO.20098-17-3): Adamantane derivatives;Adamantanes 
SMILES: ClC13CC2C(=O)C(C1)CC(C2)C3
InChI: InChI=1/C10H13ClO/c11-10-3-6-1-7(4-10)9(12)8(2-6)5-10/h6-8H,1-5H2
InChIKey: JPEOUSFBWXVGFX-UHFFFAOYAD
Std. InChI: InChI=1S/C10H13ClO/c11-10-3-6-1-7(4-10)9(12)8(2-6)5-10/h6-8H,1-5H2
Std. InChIKey: JPEOUSFBWXVGFX-UHFFFAOYSA-N

Safety Information about 5-Chloro-2-adamantanone (CAS NO.20098-17-3):
Hazard Codes: Xn
Risk Statements: 20/21/22-36/37/38
R20/21/22: Harmful by inhalation, in contact with skin and if swallowed. 
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36: Wear suitable protective clothing.