Bis(1-hydroxy-1H-pyridine-2-thionato-O,S)copper supplier

Name
Bis(1-hydroxy-1H-pyridine-2-thionato-O,S)copper
EINECS 238-984-0
CAS No. 14915-37-8
Article Data1
CAS DataBase
Density 1.8106 at 22.5°C
Solubility
Melting Point
Formula C₁₀H₈CuN₂O₂S₂
Boiling Point 253.8 °C at 760 mmHg
Molecular Weight 315.864
Flash Point 107.3 °C
Transport Information
Appearance similar to green crystalline fine powder.
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Copper, bis(1-hydroxy-2(1H)-pyridinethionato-O,S)-;NSC 290408;
PSA 120.16000
LogP 3.12450

Bis(1-hydroxy-1H-pyridine-2-thionato-O,S)copper Specification

The Bis(1-hydroxy-1H-pyridine-2-thionato-O,S)copper, with the CAS registry number 14915-37-8, is also known as Copper(2+) bis(2-thioxo-1(2H)-pyridinolate). Its EINECS registry number is 238-984-0. This chemical's molecular formula is C₁₀H₈CuN₂O₂S₂ and molecular weight is 315.86. What's more, its IUPAC name is called Copper 1-oxidopyridine-2-thione.

Physical properties about Bis(1-hydroxy-1H-pyridine-2-thionato-O,S)copper are: (1)ACD/LogP: -0.051; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.91; (4)ACD/LogD (pH 7.4): -2.74; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 3.06; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 55.56 Å²; (13)Flash Point: 107.3 °C; (14)Enthalpy of Vaporization: 57.06 kJ/mol; (15)Boiling Point: 253.8 °C at 760 mmHg; (16)Vapour Pressure: 0.00275 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: [Cu+2].S=C1/C=C\C=C/N1[O-].S=C\1N([O-])\C=C/C=C/1
(2) InChI: InChI=1S/2C5H4NOS.Cu/c2*7-6-4-2-1-3-5(6)8;/h2*1-4H;/q2*-1;+2
(3) InChIKey: XDUPUJNNHFTMQS-UHFFFAOYSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
rabbit	LD50	skin	> 2gm/kg (2000mg/kg)		National Technical Information Service. Vol. OTS0554076,
rat	LC50	inhalation	70mg/m³/4H (70mg/m³)	SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE LUNGS, THORAX, OR RESPIRATION: DYSPNEA LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION	National Technical Information Service. Vol. OTS0554076,
rat	LD50	oral	1075mg/kg (1075mg/kg)		National Technical Information Service. Vol. OTS0554076,

Product Name

Bis(1-hydroxy-1H-pyridine-2-thionato-O,S)copper

Bis(1-hydroxy-1H-pyridine-2-thionato-O,S)copper Specification

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