Phenol, 4-(trifluoromethoxy)-


Chemical Name: Phenol, 4-(trifluoromethoxy)-
CAS Number: 828-27-3
Product Number: AG0033U3(AGN-PC-0JL9F1)
Synonyms:
MDL No:
Molecular Formula: C7H5F3O2
Molecular Weight: 178.1086

Identification/Properties


Properties
MP:
17-18°C
BP:
92°C at 25 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.447(lit.)
Computed Properties
Molecular Weight:
178.11g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
178.024g/mol
Monoisotopic Mass:
178.024g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
138
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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