1,3-Benzenediol, 4-butyl-


Chemical Name: 1,3-Benzenediol, 4-butyl-
CAS Number: 18979-61-8
Product Number: AG002DZ4(AGN-PC-0JN0WY)
Synonyms:
MDL No:
Molecular Formula: C10H14O2
Molecular Weight: 166.2170

Identification/Properties


Properties
MP:
50.0 to 55.0 °C
BP:
300.7°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
166.22g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
166.099g/mol
Monoisotopic Mass:
166.099g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
125
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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