Chemical ID: 7117178

CC(=O)Nc1ccc(c(c1)C(F)(F)F)C(F)(F)F
Chemical ID:
7117178
Name [?]:
N-[3,4-bis(trifluoromethyl)phenyl]acetamide
SMILES [?]:
CC(=O)Nc1ccc(c(c1)C(F)(F)F)C(F)(F)F
InChi [?]:
InChI=1/C10H7F6NO/c1-5(18)17-6-2-3-7(9(11,12)13)8(4-6)10(14,15)16/h2-4H,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,6,7,10,2,5,8,9,15,11,16,17,18,12,13,14,4,3/E:(11,12,13)(14,15,16)/rA:18nCCONCCCCCCCFFFCFFF/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s9;s11;s11;s11;s8;s15;s15;s15;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H7F6NO
All Atoms:25
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:5.57465
Area:369.199
Solvation:-3.65532
Coulombic:-53.969
Bond Count [?]
All:18
Single:14
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:271.159
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.13
LogP (Chemaxon):3.14

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Descriptor Annotations

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