CAS RN: 5865-91-8

METHYLTRIETHOXYGERMANE

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  • Product code: starshine_CAS5865-91-8
  • Purity/Analytical Methods: >99.0%
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5865-91-8 / triethoxy(methyl)germane

Standard CAS: 5865-91-8 Multi CAS: No

Basic Information

CAS
5865-91-8
Multi CAS
No
Molecular Formula
C7GeH18O3
Molecular Weight
222.850000
Exact Mass
224.046772
InChI
InChI=1S/C7H18GeO3/c1-5-9-8(4,10-6-2)11-7-3/h5-7H2,1-4H3
InChIKey
NQDLHPSPSFDVJE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
6
H-bond acceptors
3
Molar refractivity
46.5
TPSA
27.69

LogP / Solubility

WLOGP
1.66
MLOGP
1.47
XLogP3
1.66
Consensus LogP
1.6
Log S (ESOL)
-1.87
Class (ESOL)
Soluble
Log S (Ali)
-2.59
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.21
Class (SILICOS-IT)
Poorly 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)
-2.9

Drug-likeness / Medicinal Chemistry

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

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