Benzoic acid, 4-(heptyloxy)-


Chemical Name: Benzoic acid, 4-(heptyloxy)-
CAS Number: 15872-42-1
Product Number: AG001QS2(AGN-PC-0JLVIM)
Synonyms:
MDL No:
Molecular Formula: C14H20O3
Molecular Weight: 236.3068

Identification/Properties


Properties
MP:
146 °C(lit.)
BP:
361.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.5800 (estimate)
Computed Properties
Molecular Weight:
236.311g/mol
XLogP3:
4.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
8
Exact Mass:
236.141g/mol
Monoisotopic Mass:
236.141g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
208
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


NMR Spectrum


Other Analytical Data


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