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Chemical ID: 7197241
Chemical ID:
7197241
Name [?]:
2-[3-(difluoromethyl)-5-methyl-pyrazol-1-yl]acetohydrazide
SMILES [?]:
Cc1cc(nn1CC(=O)NN)C(F)F
InChi [?]:
InChI=1/C7H10F2N4O/c1-4-2-5(7(8)9)12-13(4)3-6(14)11-10/h2,7H,3,10H2,1H3,(H,11,14)
InChi Info:
AuxInfo=1/1/N:1,3,7,2,4,8,12,13,14,11,10,5,6,9/E:(8,9)/rA:14nCCCCNNCCONNCFF/rB:s1;d2;s3;d4;s2s5;s6;s7;d8;s8;s10;s4;s12;s12;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C7H10F2N4O |
All Atoms: | 24 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 3.3208 |
Area: | 357.844 |
Solvation: | -5.6253 |
Coulombic: | -38.9659 |
Bond Count [?]
All: | 14 |
Single: | 11 |
Double: | 3 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 204.177 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 3 |
XLogP: | -0.47 |
LogP (Chemaxon): | -0.54 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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