Chemical ID: 4168330

Cc1ccc2c(c1)[nH]c(n2)C(C(F)(F)F)F
Chemical ID:
4168330
Name [?]:
5-methyl-2-(1,2,2,2-tetrafluoroethyl)-3H-benzoimidazole
SMILES [?]:
Cc1ccc2c(c1)[nH]c(n2)C(C(F)(F)F)F
InChi [?]:
InChI=1/C10H8F4N2/c1-5-2-3-6-7(4-5)16-9(15-6)8(11)10(12,13)14/h2-4,8H,1H3,(H,15,16)
InChi Info:
AuxInfo=1/1/N:1,3,4,7,2,5,6,11,9,12,16,13,14,15,10,8/E:(12,13,14)/rA:16cCCCCCCCNCNCCFFFF/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s5d9;s9;s11;s12;s12;s12;s11;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H8F4N2
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:6.10952
Area:355.074
Solvation:-2.76733
Coulombic:-39.6414
Bond Count [?]
All:17
Single:13
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:232.178
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.38
LogP (Chemaxon):3.51

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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