Chemical ID: 7090945

c1ccc(c(c1)OC(F)(F)F)S(=O)(=O)N
Chemical ID:
7090945
Name [?]:
2-(trifluoromethoxy)benzenesulfonamide
SMILES [?]:
c1ccc(c(c1)OC(F)(F)F)S(=O)(=O)N
InChi [?]:
InChI=1/C7H6F3NO3S/c8-7(9,10)14-5-3-1-2-4-6(5)15(11,12)13/h1-4H,(H2,11,12,13)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,4,8,9,10,11,15,13,14,7,12/E:(8,9,10)(12,13)/CRV:15.6/rA:15nCCCCCCOCFFFSOON/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s8;s8;s4;d12;d12;s12;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H6F3NO3S
All Atoms:21
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:6.13583
Area:342.599
Solvation:-2.42915
Coulombic:-48.1788
Bond Count [?]
All:15
Single:10
Double:5
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:241.189
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.65
LogP (Chemaxon):1.33

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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