Benzohydrazide - CAS 613-94-5
Catalog: |
BB031086 |
Product Name: |
Benzohydrazide |
CAS: |
613-94-5 |
Synonyms: |
Benzoyl hydrazine |
IUPAC Name: | benzohydrazide |
Description: | An impurity of Isoniazid, an antibiotic used for the treatment of tuberculosis (TB). |
Molecular Weight: | 136.15 |
Molecular Formula: | C7H8N2O |
Canonical SMILES: | C1=CC=C(C=C1)C(=O)NN |
InChI: | InChI=1S/C7H8N2O/c8-9-7(10)6-4-2-1-3-5-6/h1-5H,8H2,(H,9,10) |
InChI Key: | WARCRYXKINZHGQ-UHFFFAOYSA-N |
Boiling Point: | 307.4 °C at 760 mmHg |
Melting Point: | 112-114 °C |
Purity: | 95% |
Density: | 1.164 g/cm3 |
Solubility: | Sol in water and alc; slightly sol in ether, acetone, chloroform |
Appearance: | White to off-white crystalline powder |
Storage: | Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
Decomposition: | When heated to decomposition it emits toxic fumes of /nitrogen oxides |
MDL: | MFCD00007596 |
LogP: | 1.38130 |
Vapor Pressure: | 0.0000778 [mmHg] |
GHS Hazard Statement: | H301 (85.71%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P201, P202, P261, P264, P270, P271, P280, P281, P301+P310, P302+P352, P304+P340, P305+P351+P338, P308+P313, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113461612-A | Quinolone tankyrase 2 inhibitor and preparation method and application thereof | 20210720 |
CN-113461631-A | 1,3, 4-oxadiazole neuraminidase inhibitor and preparation method and application thereof | 20210629 |
CN-113416266-A | Aromatic hydrazide compound-cyclodextrin inclusion compound and preparation method thereof | 20210623 |
CN-113321662-A | Hydrazine visual fluorescent probe molecule and preparation method thereof | 20210528 |
CN-113248351-A | Preparation method of 6-chloro-2-methoxytoluene and synthetic process of methoxyfenozide | 20210526 |
PMID | Publication Date | Title | Journal |
25699604 | 20150219 | Identification of histone deacetylase inhibitors with benzoylhydrazide scaffold that selectively inhibit class I histone deacetylases | Chemistry & biology |
24103427 | 20131115 | Synthesis and antimycobacterial activity of isoniazid derivatives from renewable fatty acids | Bioorganic & medicinal chemistry |
23208761 | 20130701 | A new dibenzoylhydrazine with insecticidal activity against Anopheles mosquito larvae | Pest management science |
23538901 | 20130328 | Synthesis, in vitro antimycobacterial and antibacterial evaluation of IMB-070593 derivatives containing a substituted benzyloxime moiety | Molecules (Basel, Switzerland) |
23414843 | 20130315 | An efficient domino reaction in ionic liquid: synthesis and biological evaluation of some pyrano- and thiopyrano-fused heterocycles | Bioorganic & medicinal chemistry letters |
Complexity: | 119 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 136.063662883 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 136.063662883 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 55.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.2 |
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