3-Chloro-4-trifluoromethoxyphenol


Chemical Name: 3-Chloro-4-trifluoromethoxyphenol
CAS Number: 1000339-94-5
Product Number: AG0000DC(AGN-PC-0WA8GT)
Synonyms:
MDL No:
Molecular Formula: C7H4ClF3O2
Molecular Weight: 212.5537

Identification/Properties


Computed Properties
Molecular Weight:
212.552g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
211.985g/mol
Monoisotopic Mass:
211.985g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
174
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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