Thiocarbohydrazide - CAS 2231-57-4

Catalog:	BB017522
Product Name:	Thiocarbohydrazide
CAS:	2231-57-4
Synonyms:	1,3-diaminothiourea

Technical Data

Safety and Hazards

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Literatures

Computed Properties

IUPAC Name:	1,3-diaminothiourea
Description:	Thiocarbohydrazide (CAS# 2231-57-4 ) is a useful research chemical.
Molecular Weight:	106.15
Molecular Formula:	CH6N4S
Canonical SMILES:	C(=S)(NN)NN
InChI:	InChI=1S/CH6N4S/c2-4-1(6)5-3/h2-3H2,(H2,4,5,6)
InChI Key:	LJTFFORYSFGNCT-UHFFFAOYSA-N
Boiling Point:	230.1 °C at 760 mmHg
Melting Point:	338 °F Decomposes
Density:	1.415 g/cm³
Appearance:	Crystalline needles and plates. used in electron microscopy to produce electron-opaque deposits for ultra structural analysis.
MDL:	MFCD00007616
LogP:	0.38030

Publication Number	Title	Priority Date
CN-113247983-A	Coupling complexing extraction agent composition and method for treating triazone production wastewater	20210610
CN-113247983-B	Coupling complexing extraction agent composition and method for treating triazone production wastewater	20210610
CN-113150672-A	Method for preparing LDHs/GO-MA self-repairing corrosion-resistant coating	20210519
CN-112973639-A	Covalent organic framework materials and preparation	20210305
CN-112760746-A	Preparation method and application of nanofiltration antibacterial material	20210206

PMID	Publication Date	Title	Journal
29782964	20180915	An in vitro approach for prioritization and evaluation of chemical effects on glucocorticoid receptor mediated adipogenesis	Toxicology and applied pharmacology
24103309	20140201	Synthesis and antimycobacterial activity of novel thiadiazolylhydrazones of 1-substituted indole-3-carboxaldehydes	Chemical biology & drug design
22580137	20120901	Synthesis, spectroscopic and biological activities studies of acyclic and macrocyclic mono and binuclear metal complexes containing a hard-soft Schiff base	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy
22719632	20120601	1,5-Bis(2-oxoindolin-3-yl-idene)thio-carbonohydrazide tetra-hydro-furan monosolvate	Acta crystallographica. Section E, Structure reports online
21723186	20111015	Novel transition metal complexes of 4-hydroxy-coumarin-3-thiocarbohydrazone: pharmacodynamic of Co(III) on rats and antimicrobial activity	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy

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GHS Hazard Statement:	H300 (97.83%): Fatal if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P260, P264, P270, P271, P280, P284, P301+P310, P302+P352, P304+P340, P310, P312, P320, P321, P322, P330, P361, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	45.5
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	106.03131738
Formal Charge:	0
Heavy Atom Count:	6
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	4
Isotope Atom Count:	0
Monoisotopic Mass:	106.03131738
Rotatable Bond Count:	0
Topological Polar Surface Area:	108 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1