CAS RN: 75422-66-1
ALLYL(CHLOROMETHYL)DIMETHYLSILANE
Product Availability
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3 package records3 with current stock1 grade group
- Product code: starshine_CAS75422-66-1
- Purity/Analytical Methods: >99.0%
75422-66-1 / chloromethyl-dimethyl-prop-2-enylsilane
Basic Information
CAS
75422-66-1
Multi CAS
Yes
Molecular Formula
C6H13CLSI
Molecular Weight
148.700000
Exact Mass
148.047505
InChI
InChI=1S/C6H13ClSi/c1-4-5-8(2,3)6-7/h4H,1,5-6H2,2-3H3
InChIKey
UHHLOVCFFWGSMO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
8
Fraction Csp3
0.67
Rotatable bonds
3
Molar refractivity
43.21
TPSA
0.0000
LogP / Solubility
WLOGP
2.66
MLOGP
2.33
XLogP3
2.66
Consensus LogP
2.55
Log S (ESOL)
-2.24
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.7
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.19
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)
-1.74
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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