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CAS 1522-22-1 Hexafluoroacetylacetone molecular structure lightbox
CAS RN: 1522-22-1

Hexafluoroacetylacetone

Product Availability

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20251125 100g In stock Inquiry
Batchno.20250211 1g In stock Inquiry
Batchno.20260224 25g In stock Inquiry
Batchno.20250827 500g Out of stock Inquiry
Batchno.20251025 5g In stock Inquiry
  • Product code: SSC-061973
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g, 10g, 25g, 100g
  • Available purity: ≥98%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1522-22-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥98% 0 Out of Stock Beijing Inquiry
10g ≥98% 0 Out of Stock Beijing Inquiry
25g ≥98% 0 Out of Stock Beijing Inquiry
100g ≥98% 0 Out of Stock Shanghai Inquiry

1522-22-1 / 1,1,1,5,5,5-hexafluoropentane-2,4-dione

Standard CAS: 1522-22-1 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
1522-22-1
Multi CAS
No
Molecular Formula
C5H2F6O2
Molecular Weight
208.060000
Exact Mass
207.995898
SMILES
C(C(=O)C(F)(F)F)C(=O)C(F)(F)F
InChI
InChI=1S/C5H2F6O2/c6-4(7,8)2(12)1-3(13)5(9,10)11/h1H2
InChIKey
QAMFBRUWYYMMGJ-UHFFFAOYSA-N

Physical Properties

Physical Description
Colorless to pale yellow liquid; Not miscible or difficult to mix in water
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
0.6
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
26.74
TPSA
34.14

LogP / Solubility

WLOGP
1.64
MLOGP
1.44
XLogP3
2
Consensus LogP
1.69
Log S (ESOL)
-2.03
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.45
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.61
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.83

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Flammable Corrosive Acute Toxic Irritant
Signal
Danger
GHS Hazard Statements
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] H301 (12.2%): Toxic if swallowed [Danger Acute toxicity, oral] H302 (87.8%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (85.7%): Harmful in contact with skin [Warning Acute toxicity, dermal] H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501

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