Computed Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.01g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.118g/mol
Monoisotopic Mass:
232.01g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Synonyms
2-NITRO-5-(TRIFLUOROMETHOXY)BENZONITRILE
1003708-58-4
AKOS016009656
AS01706
AJ-101348
AX8161266
DB-058359
TC-103007
Benzonitrile, 2-nitro-5-(trifluoromethoxy)-
CS-0084341
FT-0691817
B-6217
PubChem4820
C8H3F3N2O3
ACMC-2097pk
CTK7C7171
DTXSID90662777
0169AA
ANW-14262
MFCD09835205
ZINC39953636
