4-Chlorobenzhydrazide - CAS 536-40-3

Catalog:	BB028299
Product Name:	4-Chlorobenzhydrazide
CAS:	536-40-3
Synonyms:	4-chlorobenzohydrazide

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Computed Properties

IUPAC Name:	4-chlorobenzohydrazide
Description:	4-Chlorobenzhydrazide (CAS# 536-40-3) is a useful research chemical.
Molecular Weight:	170.60
Molecular Formula:	C7H7ClN2O
Canonical SMILES:	C1=CC(=CC=C1C(=O)NN)Cl
InChI:	InChI=1S/C7H7ClN2O/c8-6-3-1-5(2-4-6)7(11)10-9/h1-4H,9H2,(H,10,11)
InChI Key:	PKBGHORNUFQAAW-UHFFFAOYSA-N
Boiling Point:	170.60 °C
Purity:	96 %
Density:	1.323 g/cm³
Appearance:	White to light beige crystals, flakes or
MDL:	MFCD00007603
LogP:	2.03470

Publication Number	Title	Priority Date
CN-113121426-A	Synthesis method of myrtenal aldehyde group dihydrazide compounds with fungal inhibition activity	20210312
CN-112321455-A	Paeonol acylhydrazone derivative, preparation method and application thereof, and pesticide	20201106
CN-111777953-A	Thread locking anaerobic adhesive and preparation method thereof	20200731
CN-111689973-A	Dibenzocaprolactam pyrazolidine compound, preparation method and application	20200728
WO-2021187486-A1	Oxadiazole derivative	20200317

PMID	Publication Date	Title	Journal
22606148	20120401	4-Chloro-N'-(3,5-dibromo-2-hy-droxy-benzyl-idene)benzohydrazide	Acta crystallographica. Section E, Structure reports online
23125560	20120101	Synthesis, Spectroscopic Characterization, and In Vitro Antimicrobial Studies of Pyridine-2-Carboxylic Acid N'-(4-Chloro-Benzoyl)-Hydrazide and Its Co(II), Ni(II), and Cu(II) Complexes	Bioinorganic chemistry and applications
22199647	20111201	Bis{μ-4-chloro-N'-[(E)-1-(5-chloro-2-oxidophen-yl)ethyl-idene]benzohydrazidato}bis-[pyridine-copper(II)]	Acta crystallographica. Section E, Structure reports online
22219870	20111101	4-Chloro-N'-(2-hy-droxy-4-meth-oxy-benzyl-idene)benzohydrazide methanol monosolvate	Acta crystallographica. Section E, Structure reports online
21589249	20101113	(4-Chloro-benzohydrazidato-κN',O)[2-(4-chloro-benzoyl-hydrazinyl-idene-κN,O)-3-phenyl-propionato(2-)-κO]oxidovanadium(V) methanol monosolvate	Acta crystallographica. Section E, Structure reports online

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Carbonyl Compounds

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1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-

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GHS Hazard Statement:	H315 (97.78%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	143
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	170.0246905
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	170.0246905
Rotatable Bond Count:	1
Topological Polar Surface Area:	55.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1