CAS RN: 223569-31-1
TFB,Poly[(9,9-dioctylfluorenyl-2,7-diyl)-alt-(4,4′-(N-(4-butylphenyl)
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2 package records1 with current stock1 grade group
- Product code: starshine_CAS223569-31-1
- Purity/Analytical Methods: >99.0%
223569-31-1 / gallium
Basic Information
CAS
223569-31-1
Multi CAS
No
Molecular Formula
Ga
Molecular Weight
69.723000
Exact Mass
68.925570
SMILES
[Ga]
InChI
InChI=1S/Ga
InChIKey
GYHNNYVSQQEPJS-UHFFFAOYSA-N
Physical Properties
Melting Point
29.78 °C
Boiling Point
Approx 2400 °C
Density
6.0947 @ 29.8 °C (liquid); 5.9037 @ 29.65 °C (solid)
Physical Description
Gallium is a silvery-white liquid or a soft, malleable solid at room temperature. Ingestion of this material may be toxic. It is corrosive to aluminum. If exposed to high temperatures, gallium may emit toxic fumes which may form a corrosive alkaline solution with water. It is soluble in most acids and alkalis. It is used as a semiconductor material.
Other Solid
Silvery metal; [Ullmann]
Appearance
Grayish metal, possesses a greenish-blue reflection or silver-like when molten; has a crystalline ortho-rhombic texture
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
1
Molar refractivity
5.75
TPSA
0.0000
LogP / Solubility
WLOGP
-0.38
MLOGP
-0.35
XLogP3
-0.38
Consensus LogP
-0.37
Log S (ESOL)
-0.03
Class (ESOL)
Very soluble
Log S (Ali)
0.14
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.2
Class (SILICOS-IT)
Highly 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)
-3.42
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1
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