Docosanoic acid


Chemical Name: Docosanoic acid
CAS Number: 112-85-6
Product Number: AG003PV0(AGN-PC-00BFBI)
Synonyms:
MDL No:
Molecular Formula: C22H44O2
Molecular Weight: 340.5836

Identification/Properties


Properties
MP:
72-80 °C(lit.);
BP:
391.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
nD100 1.4270
Solubility:
chloroform: soluble50mg/mL, clear
Computed Properties
Molecular Weight:
340.592g/mol
XLogP3:
9.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
20
Exact Mass:
340.334g/mol
Monoisotopic Mass:
340.334g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
250
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:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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