CAS RN: 207801-28-3
YTTRIUM ACETATE HYDRATE
Product Availability
Choose a grade to view its available package options.
4 package records3 with current stock1 grade group
- Product code: starshine_CAS207801-28-3
- Purity/Analytical Methods: >99.0%
207801-28-3 / yttrium(3+);triacetate;tetrahydrate
Basic Information
CAS
207801-28-3
Multi CAS
No
Molecular Formula
C6H17O10Y
Molecular Weight
338.100000
Exact Mass
337.988010
SMILES
CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.O.O.O.[Y+3]
InChI
InChI=1S/3C2H4O2.4H2O.Y/c3*1-2(3)4;;;;;/h3*1H3,(H,3,4);4*1H2;/q;;;;;;;+3/p-3
InChIKey
AIQRTHPXPDTMBQ-UHFFFAOYSA-K
Computed Properties
Structural Parameters
Heavy atom count
17
Fraction Csp3
0.5
H-bond acceptors
6
H-bond donors
4
Molar refractivity
46.5
TPSA
246.39
LogP / Solubility
WLOGP
-7.03
MLOGP
-6.17
XLogP3
-7.03
Consensus LogP
-6.74
Log S (ESOL)
2.49
Class (ESOL)
Highly soluble
Log S (Ali)
2.75
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
3.98
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-9.78
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
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