3-t-Butyl-4-hydroxyanisole


Chemical Name: 3-t-Butyl-4-hydroxyanisole
CAS Number: 121-00-6
Product Number: AG008RDG(AGN-PC-0JK8K5)
Synonyms:
MDL No:
Molecular Formula: C11H16O2
Molecular Weight: 180.24354

Identification/Properties


Properties
MP:
58-64 °C
BP:
269.1°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Refractive Index:
1.4708 (estimate)
Solubility:
ethanol: soluble1g/10 mL, clear, colorless to faint yellow or tan
Computed Properties
Molecular Weight:
180.247g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
180.115g/mol
Monoisotopic Mass:
180.115g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
160
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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