Gold,dimethyl(1,1,1-trifluoro-2,4-pentanedionato-kO2,kO4)-, (SP-4-3)- supplier

Name
DIMETHYL(TRIFLUOROACETYLACETONATE)GOLD (III)
EINECS
CAS No. 63470-53-1
Density
Solubility
Melting Point
Formula C₇H₁₀AuF₃O₂
Boiling Point 195.6 °C at 760 mmHg
Molecular Weight 380.1149
Flash Point 72.1 °C
Transport Information
Appearance
Safety 26-36/37/39-45
Risk Codes 23/24/25
Molecular Structure
Hazard Symbols
Synonyms Gold,dimethyl(1,1,1-trifluoro-2,4-pentanedionato-O,O')-, (SP-4-3)-;Gold,dimethyl(1,1,1-trifluoro-2,4-pentanedionato-kO,kO')-, (SP-4-3)- (9CI);2,4-Pentanedione, 1,1,1-trifluoro-, gold complex;(1,1,1-Trifluoroacetylacetonato)dimethylgold;Dimethyl(1,1,1-trifluoro-2,4-pentanedionato)gold;Dimethyl(trifluoroacetylacetonato)gold;Dimethylgold trifluoroacetylacetonate;
PSA 26.30000
LogP 2.66760

Gold,dimethyl(1,1,1-trifluoro-2,4-pentanedionato-kO2,kO4)-, (SP-4-3)- Specification

The Gold,dimethyl(1,1,1-trifluoro-2,4-pentanedionato-kO2,kO4)-, (SP-4-3)-, with the CAS registry number 63470-53-1, has the molecular formula C₇H₁₀AuF₃O₂. Besides, its molecular weight is 380.029841. Its IUPAC name is called carbanide; gold(3+); (Z)-1,1,1-trifluoro-4-oxopent-2-en-2-olate. The product should be sealed and stored in cool and dry place.

Physical properties of Gold,dimethyl(1,1,1-trifluoro-2,4-pentanedionato-kO2,kO4)-, (SP-4-3)-: (1)ACD/LogP: 2.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.7; (4)ACD/LogD (pH 7.4): 2.63; (5)ACD/BCF (pH 5.5): 66.82; (6)ACD/BCF (pH 7.4): 55.91; (7)ACD/KOC (pH 5.5): 704.04; (8)ACD/KOC (pH 7.4): 589.02; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Flash Point: 72.1 °C; (13)Enthalpy of Vaporization: 50.24 kJ/mol; (14)Boiling Point: 195.6 °C at 760 mmHg; (15)Vapour Pressure: 0.108 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is toxic by inhalation, in contact with skin and if swallowed. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: [CH3-].[CH3-].CC(=O)C=C(C(F)(F)F)[O-].[Au+3]
(2)Isomeric SMILES: [CH3-].[CH3-].CC(=O)/C=C(/C(F)(F)F)\[O-].[Au+3]
(3)InChI: InChI=1S/C5H5F3O2.2CH3.Au/c1-3(9)2-4(10)5(6,7)8;;;/h2,10H,1H3;2*1H3;/q;2*-1;+3/p-1/b4-2-;;;
(4)InChIKey: BHCGHWWGHSVXTA-GCOIFOBGSA-M

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
rat	LC50	inhalation	81mg/m³/4H (81mg/m³)	SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION	National Technical Information Service. Vol. OTS0518508-1,

Product Name

DIMETHYL(TRIFLUOROACETYLACETONATE)GOLD (III)

Gold,dimethyl(1,1,1-trifluoro-2,4-pentanedionato-kO2,kO4)-, (SP-4-3)- Specification

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