Isoniazid EP Impurity D - CAS 553-53-7
Catalog: |
BB029006 |
Product Name: |
Isoniazid EP Impurity D |
CAS: |
553-53-7 |
Synonyms: |
Nicotinic hydrazide; nicotinoyl hydrazide |
IUPAC Name: | pyridine-3-carbohydrazide |
Description: | An impurity of Isoniazid, an antibiotic used for the treatment of tuberculosis (TB). |
Molecular Weight: | 137.14 |
Molecular Formula: | C6H7N3O |
Canonical SMILES: | C1=CC(=CN=C1)C(=O)NN |
InChI: | InChI=1S/C6H7N3O/c7-9-6(10)5-2-1-3-8-4-5/h1-4H,7H2,(H,9,10) |
InChI Key: | KFUSANSHCADHNJ-UHFFFAOYSA-N |
Purity: | 98% |
Density: | 1.244 g/cm3 |
Appearance: | White to off-white fine needle-like cryst. powder |
MDL: | MFCD00006383 |
LogP: | 0.77630 |
GHS Hazard Statement: | H315 (91.49%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P201, P202, P261, P264, P271, P280, P281, P302+P352, P304+P340, P305+P351+P338, P308+P313, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113416266-A | Aromatic hydrazide compound-cyclodextrin inclusion compound and preparation method thereof | 20210623 |
CN-112592339-A | 1,3, 4-oxadiazole-2 (3H) -thione-norfloxacin heterozygote and preparation method and application thereof | 20201222 |
CN-112680060-A | Corrosion-resistant composite coating material and preparation method thereof | 20201221 |
CN-112321455-A | Paeonol acylhydrazone derivative, preparation method and application thereof, and pesticide | 20201106 |
CN-112321504-A | Application of 4-diethylamino salicylaldehyde nicotinylhydrazone in preparation of molecular probe, molecular probe and preparation method and application of molecular probe | 20201016 |
PMID | Publication Date | Title | Journal |
28715707 | 20170929 | Design, synthesis and 2D QSAR study of novel pyridine and quinolone hydrazone derivatives as potential antimicrobial and antitubercular agents | European journal of medicinal chemistry |
22542687 | 20120901 | Structural investigation of aroylhydrazones in dimethylsulphoxide/water mixtures | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
22935498 | 20120901 | Rietveld refinement of the cocrystal 2,4-dihydroxybenzoic acid-N'-(propan-2-ylidene)nicotinohydrazide (1/1) | Acta crystallographica. Section C, Crystal structure communications |
22259474 | 20120101 | Form II of adipic acid-nicotinohydrazide (1/2) | Acta crystallographica. Section E, Structure reports online |
22199774 | 20111201 | N'-[(E)-Furan-2-yl-methyl-idene]pyridine-3-carbohydrazide | Acta crystallographica. Section E, Structure reports online |
Complexity: | 126 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 137.058911855 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 137.058911855 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 68 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.7 |
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