3-(Trifluoromethyl)cyclobutanecarboxylic acid


Chemical Name: 3-(Trifluoromethyl)cyclobutanecarboxylic acid
CAS Number: 1093750-93-6
Product Number: AG00HBFV(AGN-PC-0WBT5L)
Synonyms:
MDL No: MFCD15526994
Molecular Formula: C6H7F3O2
Molecular Weight: 168.1138

Identification/Properties


Computed Properties
Molecular Weight:
168.115g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
168.04g/mol
Monoisotopic Mass:
168.04g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
169
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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