Chemical ID: 6396563

Cc1cccc(c1)NC(=O)c2cccc(c2)F
Chemical ID:
6396563
Name [?]:
3-fluoro-N-(m-tolyl)benzamide
SMILES [?]:
Cc1cccc(c1)NC(=O)c2cccc(c2)F
InChi [?]:
InChI=1/C14H12FNO/c1-10-4-2-7-13(8-10)16-14(17)11-5-3-6-12(15)9-11/h2-9H,1H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,4,13,3,12,14,5,7,16,2,11,15,6,9,17,8,10/rA:17nCCCCCCCNCOCCCCCCF/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;d12;s13;d14;d11s15;s15;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12FNO
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:7.50838
Area:406.34
Solvation:-2.65013
Coulombic:-26.2911
Bond Count [?]
All:18
Single:11
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:229.25
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.59
LogP (Chemaxon):3.71

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Descriptor Annotations

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