Computed Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.06g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.673g/mol
Monoisotopic Mass:
212.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
Synonyms
1000341-32-1
3-Chloro-5-tert-butylbenzoic acid
3-(tert-Butyl)-5-chlorobenzoic acid
DTXSID00646942
3-tert-butyl-5-chlorobenzoic acid
ZINC42689522
W-1078
Benzoic acid, 3-chloro-5-(1,1-dimethylethyl)-
