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: 100g
Available purity: ≥95%
Inventory rows with stock: 0
Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 7585-20-8
Pack Size
Recorded Purity
Available Qty
Ship From
Inquiry
100g
≥95%
0
Out of Stock
Beijing
Inquiry
7585-20-8 / acetic acid;zirconium
Standard CAS: 7585-20-8
Multi CAS: Yes
Basic Information
copy
CAS
7585-20-8 copy
Multi CAS
Yes copy
Molecular Formula
C2H4O2Zr copy
Molecular Weight
151.270000 copy
Exact Mass
149.925828 copy
InChI
InChI=1S/4C2H4O2.Zr/c4*1-2(3)4;/h4*1H3,(H,3,4);/q;;;;+4/p-4 copy
InChIKey
MFFVROSEPLMJAP-UHFFFAOYSA-J copy
Computed Properties
copy
Structural Parameters
Heavy atom count
5 copy
Fraction Csp3
0.5 copy
H-bond acceptors
1 copy
H-bond donors
1 copy
Molar refractivity
13.31 copy
TPSA
37.3 copy
LogP / Solubility
WLOGP
0.09 copy
MLOGP
0.07 copy
XLogP3
0.09 copy
Consensus LogP
0.08 copy
Log S (ESOL)
-0.83 copy
Class (ESOL)
Very soluble copy
Log S (Ali)
-0.86 copy
Class (Ali)
Very soluble copy
Log S (SILICOS-IT)
-0.72 copy
Class (SILICOS-IT)
Very soluble copy
ADME
GI absorption
High copy
BBB permeant
Yes copy
P-gp substrate
No copy
CYP1A2 inhibitor
No copy
CYP2C19 inhibitor
No copy
CYP2C9 inhibitor
No copy
CYP2D6 inhibitor
No copy
CYP3A4 inhibitor
No copy
Log Kp (skin permeation)
-3.58 copy
Drug-likeness / Medicinal Chemistry
Lipinski
Yes copy
Ghose
No copy
Veber
Yes copy
Egan
Yes copy
Muegge
No copy
Bioavailability score
0.55 copy
Leadlikeness
No copy
Synthetic Accessibility
1 copy