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Chemical ID: 4254095
Chemical ID:
4254095
Name [?]:
3-(3,4-dihydroxyphenyl)propanehydrazide
SMILES [?]:
c1cc(c(cc1CCC(=O)NN)O)O
InChi [?]:
InChI=1/C9H12N2O3/c10-11-9(14)4-2-6-1-3-7(12)8(13)5-6/h1,3,5,12-13H,2,4,10H2,(H,11,14)
InChi Info:
AuxInfo=1/1/N:1,7,2,8,5,6,3,4,9,12,11,14,13,10/rA:14nCCCCCCCCCONNOO/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;d9;s9;s11;s4;s3;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C9H12N2O3 |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 4.69136 |
Area: | 379.435 |
Solvation: | -4.79452 |
Coulombic: | -57.7281 |
Bond Count [?]
All: | 14 |
Single: | 10 |
Double: | 4 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 196.203 |
H-Bond Donors: | 5 |
H-Bond Acceptors: | 5 |
XLogP: | 0.03 |
LogP (Chemaxon): | 0.63 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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