Benzoic acid, 2-ethylhexyl ester


Chemical Name: Benzoic acid, 2-ethylhexyl ester
CAS Number: 5444-75-7
Product Number: AG003O2D(AGN-PC-05RCSP)
Synonyms:
MDL No:
Molecular Formula: C15H22O2
Molecular Weight: 234.3340

Identification/Properties


Properties
BP:
313.1°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
1.4890-1.4930
Computed Properties
Molecular Weight:
234.339g/mol
XLogP3:
4.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
8
Exact Mass:
234.162g/mol
Monoisotopic Mass:
234.162g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
207
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


NMR Spectrum


Other Analytical Data


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