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Bis(1,1,1-trifluoropentane-2,4-dionato-O,O')copper

HCID 5483683
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Basic information

CAS
14324-82-4
Standard SMILES
CC(=O)/C=C(\[O-])C(F)(F)F.CC(=O)/C=C(\[O-])C(F)(F)F.[Cu+2]
InChIKey
GZVJAFMHAGQIEB-BGHCZBHZSA-L
Molecular formula
C10H8CuF6O4
Average molar mass
369.7 g/mol
Monoisotopic mass
368.962275

Overview

See also: Bis(trifluoro-2,4-pentanedionato)copper(II) (annotation moved to).

Names & identifiers

Preferred name
Bis(1,1,1-trifluoropentane-2,4-dionato-O,O')copper
IUPAC
copper bis((Z)-1,1,1-trifluoro-4-oxopent-2-en-2-olate)
English name
Copper(II) trifluoroacetylacetonate
Molecular formula
C10H8CuF6O4
Molecular weight
369.7

Names & synonyms

AI3-61599EINECS 238-271-4NSC 49748Bis(1,1,1-trifluoropentane-2,4-dionato-O,O')copperCopper, bis(1,1,1-trifluoro-2,4-pentanedionato-O,O')-RefChem:568492238-271-414324-82-423677-93-2Copper, bis[2-(trifluoromethyl)acetoacetaldehydato]- (8CI)SY061917copper;(Z)-1,1,1-trifluoro-4-oxo-pent-2-en-2-olate
Show more names
CUPRIC TRIFLUOROACETYLACETONATETRIFLUOROACETYL ACETONE, CU(II)COPPER TRIFLUOROACETLYACETONATECOPPER II TRIFLUOROPENTANEDIONATECopper(II) trifluoroacetylacetonateCopper bis(trifluoroacetylacetonate)Cupric 1,1,1-trifluoroacetylacetonateCopper 1,1,1-trifluoroacetylacetonateTRIFLUOROACETYLACETONO COPPER(II) SALTCOPPER(II)TRIFLUORO-2,4-PENTANEDIONATE

Properties

Computed structural properties

Topological polar surface area
80.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
10
Rotatable bonds
2
Heavy atoms
21
Formal charge
0
Complexity
168

Physicochemical properties

Melting point
198 · 198-199 °C (lit.)
Boiling point
260 °C · 260°C
Density
0.721 g/cm3 · 0.721 g/cm3
Flash point
260 °C · 260°C
storage temp.
2 · 2-8°C, protect from light, stored under nitrogen
solubility
soluble in ethanol, toluene
form
Powder
color
purple
Hydrolytic Sensitivity
4 · 4: no reaction with water under neutral conditions
InChI
InChI=1S/2C5H5F3O2.Cu/c2*1-3(9)2-4(10)5(6,7)8;/h2*2,9H,1H3;/q;;+2/p-2/b2*3-2-;
InChIKey
GZVJAFMHAGQIEB-BGHCZBHZSA-L
SMILES
C(=O)(/C=C(/C)\O[Cu]O/C(/C)=C\C(=O)C(F)(F)F)C(F)(F)F
UNSPSC Code
12352103 · 12352103
NACRES
23 · NA.23
Symbol(GHS)
7 · GHS07
Signal word
Warning

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
tsca
No
hs_code
2914790090
risk_code
20/21/22-36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
T
hazard_note
Toxic
safety_code
22-24/25
Storage Class
11 - Combustible Solids
Hazard statements
H315-H319-H335
Precautionary statements
P280-P302+P352-P305+P351+P338

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes

Database identifiers

CAS
14324-82-4
PubChem CID
5483683
EC Number
238-271-4
Hazard statements
315 · H315-H319-H335
Precautionary statements
280 · P280-P302+P352-P305+P351+P338
PPE
95 · Eyeshields, Gloves, type N95 (US)
Hazard Codes
T
Risk Statements
20 · 20/21/22-36/37/38
Safety Statements
22 · 22-24/25
WGK Germany
3 · 3
Hazard Note
Toxic
TSCA
No
HS Code
2914790090 · 2914790090
Storage Class
11 · 11 - Combustible Solids