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Chemical ID: 4699953
Chemical ID:
4699953
Name [?]:
2-hydrazino-2-oxo-N-[3-(trifluoromethyl)phenyl]-acetamide
SMILES [?]:
c1cc(cc(c1)NC(=O)C(=O)NN)C(F)(F)F
InChi [?]:
InChI=1/C9H8F3N3O2/c10-9(11,12)5-2-1-3-6(4-5)14-7(16)8(17)15-13/h1-4H,13H2,(H,14,16)(H,15,17)
InChi Info:
AuxInfo=1/1/N:1,2,6,4,3,5,8,10,14,15,16,17,13,7,12,9,11/E:(10,11,12)/rA:17nCCCCCCNCOCONNCFFF/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;d10;s10;s12;s3;s14;s14;s14;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C9H8F3N3O2 |
All Atoms: | 17 |
Heavy Atoms: | 17 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.81482 |
Area: | 392.032 |
Solvation: | -2.98598 |
Coulombic: | -70.9995 |
Bond Count [?]
All: | 17 |
Single: | 12 |
Double: | 5 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 247.174 |
H-Bond Donors: | 4 |
H-Bond Acceptors: | 5 |
XLogP: | 0.39 |
LogP (Chemaxon): | 1.3 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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