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Chemical ID: 6538899
Chemical ID:
6538899
Name [?]:
N,N-dicyclohexyl-2,3,4,5-tetrafluoro-benzamide
SMILES [?]:
c1c(c(c(c(c1F)F)F)F)C(=O)N(C2CCCCC2)C3CCCCC3
InChi [?]:
InChI=1/C19H23F4NO/c20-15-11-14(16(21)18(23)17(15)22)19(25)24(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h11-13H,1-10H2
InChi Info:
AuxInfo=1/0/N:17,23,16,18,22,24,15,19,21,25,1,14,20,2,6,3,5,4,11,7,10,8,9,13,12/E:(1,2)(3,4,5,6)(7,8,9,10)(12,13)/rA:25nCCCCCCFFFFCONCCCCCCCCCCCC/rB:s1;d2;s3;d4;d1s5;s6;s5;s4;s3;s2;d11;s11;s13;s14;s15;s16;s17;s14s18;s13;s20;s21;s22;s23;s20s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C19H23F4NO |
All Atoms: | 25 |
Heavy Atoms: | 25 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.88874 |
Area: | 494.086 |
Solvation: | -5.46342 |
Coulombic: | -29.485 |
Bond Count [?]
All: | 27 |
Single: | 23 |
Double: | 4 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 357.386 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 2 |
XLogP: | 5.87 |
LogP (Chemaxon): | 4.92 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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