2,5,8,11-Tetraoxadodecane


Chemical Name: 2,5,8,11-Tetraoxadodecane
CAS Number: 112-49-2
Product Number: AG003V1W(AGN-PC-0JK8F7)
Synonyms:
MDL No:
Molecular Formula: C8H18O4
Molecular Weight: 178.2261

Identification/Properties


Properties
MP:
-45 °C(lit.);
BP:
197.2°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Stability:
Hygroscopic
Refractive Index:
n20/D 1.423(lit.)
Solubility:
>1000g/l soluble
Computed Properties
Molecular Weight:
178.228g/mol
XLogP3:
-0.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
9
Exact Mass:
178.121g/mol
Monoisotopic Mass:
178.121g/mol
Topological Polar Surface Area:
36.9A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
67.5
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#:
3082
Hazard Statements:
H319-H360-H412
Precautionary Statements:
P201-P202-P273-P280-P305+P351+P338-P308+P313-P337+P313-P405-P501
Class:
9
Packing Group:

NMR Spectrum


Other Analytical Data


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