1,3-Dimethyladamantane


Chemical Name: 1,3-Dimethyladamantane
CAS Number: 702-79-4
Product Number: AG0032LV(AGN-PC-0WA446)
Synonyms:
MDL No:
Molecular Formula: C12H20
Molecular Weight: 164.2872

Identification/Properties


Properties
MP:
-30 °C
BP:
199.9 °C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.478(lit.)
Computed Properties
Molecular Weight:
164.292g/mol
XLogP3:
4.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
0
Rotatable Bond Count:
0
Exact Mass:
164.157g/mol
Monoisotopic Mass:
164.157g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
182
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3295
Hazard Statements:
H226
Precautionary Statements:
P210-P403+P235
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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