Chemical ID: 4259616

CC[NH2+]C(C)Cc1cccc(c1)C(F)(F)F
Chemical ID:
4259616
Name [?]:
ethyl-[1-methyl-2-[3-(trifluoromethyl)phenyl]-ethyl]-ammonium
SMILES [?]:
CC[NH2+]C(C)Cc1cccc(c1)C(F)(F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H17F3N+
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:-24.1477
Area:395.705
Solvation:-34.0403
Coulombic:15.1822
Bond Count [?]
All:16
Single:13
Double:3
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:232.265
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:3.5
LogP (Chemaxon):3.46

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue