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1,3-Dimethyladamantane Structure

1,3-Dimethyladamantane

Chemical Properties

Melting point -30 °C
Boiling point 201.5 °C
Density  0.886 g/mL at 25 °C (lit.)
refractive index  n20/D 1.478(lit.)
Flash point 127 °F
storage temp.  2-8°C
solubility  Chloroform (Slightly), Methanol (Slightly)
form  clear liquid
color  Colorless to Almost colorless
Specific Gravity 0.886
Stability Stable. Incompatible with strong oxidizing agents. Flammable.
InChI InChI=1S/C12H20/c1-11-4-9-3-10(5-11)7-12(2,6-9)8-11/h9-10H,3-8H2,1-2H3
InChIKey CWNOIUTVJRWADX-UHFFFAOYSA-N
SMILES C12(C)CC3CC(CC(C)(C3)C1)C2
CAS DataBase Reference 702-79-4(CAS DataBase Reference)
FDA UNII 96G4OD5Z59
NIST Chemistry Reference Adamantane, 1,3-dimethyl-(702-79-4)

Safety

Symbol(GHS)
Signal wordWarning
Hazard statements H226
Precautionary statements P210-P233-P240-P241-P242-P243
Hazard Codes  F
Risk Statements  10
Safety Statements  16-60
RIDADR  UN 1993 3/PG 3
WGK Germany  3
HazardClass  3
PackingGroup  III
HS Code  29021990
NFPA 704:
2
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