UCSF

ZINC12358633

Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 10 No

Other Names:

"1,1,1-Trifluoro-2,4-pentanedione, 98%"

(Trifluoroacetyl)acetone, 2,4-Dioxo-1,1,1-trifluoropentane

1,1,1-Trifluoro-2,4-pentanedione, 98%

1,1,1-Trifluoroacetylacetone

1,1,1-trifluoropentane-2,4-dione

1,1,1-Trifluoropentane-2,4-dione 99%

3-Penten-2-one, 1,1,1-trifluoro-4-hydroxy-

3-Penten-2-one, 5,5,5-trifluoro-4-hydroxy-

Aluminium trifluoroacetylacetonate 98%

BERYLLIUM TRIFLUOROACETYLACETONATE HYDRATE

Bis(trifluoro-2,4-pentanedionato)magnesium(ii)

Copper(II) hexafluoro-2,4-pentanedionate hydrate

Copper(II) hexafluoro-2,4-pentanedionate hydrate, 99.99% (metals basis)

Copper(II) trifluoroacetylacetonate 97%

Dimethyl(trifluoroacetylacetonate)gold(III)

Hafnium 1,1,1-trifluoro-2,4-pentanedionate

Hafnium trifluoroacetylacetonate

Iron (III) trifluoroacetylacetonate 99%

Iron(III) 1,1,1-trifluoro 2,4-pentanedionate

Iron(III) trifluoroacetylacetonate

LS-102068

Magnesium 1,1,1-trifluoro-2,4-pentanedionate dihydrate

Magnesium 1,1,1-trifluoro-2,4-pentanedionate dihydrate, 98%

Magnesium trifluoroacetylacetonate dihydrate 98%

MFCD00000427

MFCD00017760

MFCD00042062

MFCD00058831

MFCD00059456

MFCD00077561

MFCD00078027

MFCD00150656

MFCD00151019

MFCD03940297

Neodymium trifluoroacetylacetonate

Nickel trifluoroacetylacetonate, dihydrate

Nickel(II) 1,1,1-trifluoro-2,4-pentanedionate dihydrate

Nickel(II) 1,1,1-trifluoroacetylacetonate dihydrate

Praesodymium trifluoroacetylacetonate 99%

QA-3614

Tfpd-H

Trifluoroacetylacetone

TRIFLUOROPENTANEDION

TRIS(TRIFLUORO-2,4-PENTANEDIONATO)ALUMINUM(III)

Tris(trifluoro-2,4-pentanedionato)chromium(III)

Zirconium trifluoroacetylacetonate 98%

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.97 3.59 -39.67 0 2 -1 40 153.079 2
Ref Reference (pH 7) 0.97 3.64 -38.41 0 2 -1 40 153.079 2
Mid Mid (pH 6-8) 0.22 2.05 -11.44 0 2 0 34 154.087 3

Vendor Notes

Note Type Comments Provided By
BP 101 TCI
BP [°C] 105 - 107 Acros Organics
Boiling_Point 105-107? Alfa-Aesar
BP 105-107° Matrix Scientific
Melting_Point 110-112? Alfa-Aesar
Melting_Point 110-112° Alfa-Aesar
MP 121 TCI
Melting_Point 128-129? Alfa-Aesar
Melting_Point 128-129° Alfa-Aesar
MP 140-142° Fluorochem
Boiling_Point 220? dec. Alfa-Aesar
Boiling_Point 220° dec. Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Fluorochem
Purity 98% Matrix Scientific
Melting_Point ca 100? Alfa-Aesar
Melting_Point ca 100° Alfa-Aesar
Warnings Flammable/Refrigerate Matrix Scientific
H phrase H315: Causes skin irritation Acros Organics
H phrase H315: Causes skin irritation; H302: Harmful if swallowed; H319: Causes serious eye irritation; H312: Harmful in contact with skin; H332: Harmful if inhaled; H335: May cause respiratory irritation; H226: Flammable liquid and vapor Acros Organics
Warnings IRRITANT, FLAMMABLE Matrix Scientific
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection Acros Organics
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/p Acros Organics
R phrase R10: Flammable. Acros Organics
R phrase R10: Flammable.; R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin. Acros Organics
S phrase S16: Keep away from sources of ignition - No smoking. Acros Organics
S phrase S16: Keep away from sources of ignition - No smoking.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection. Acros Organics
Hazard XN: Harmful Acros Organics

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.