Octanoic acid, 2-ethylhexyl ester


Chemical Name: Octanoic acid, 2-ethylhexyl ester
CAS Number: 63321-70-0
Product Number: AG003H7W(AGN-PC-0JLCM5)
Synonyms:
MDL No:
Molecular Formula: C16H32O2
Molecular Weight: 256.4241

Identification/Properties


Properties
BP:
296 °C
Storage:
Room Temperature;
Computed Properties
Molecular Weight:
256.43g/mol
XLogP3:
6.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
13
Exact Mass:
256.24g/mol
Monoisotopic Mass:
256.24g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
190
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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