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CAS 206450-45-5 3-Chloropropyl Diallyl Methylsilane molecular structure lightbox
CAS RN: 206450-45-5

3-Chloropropyl Diallyl Methylsilane

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260127 25g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS206450-45-5
  • Purity/Analytical Methods: >99.0%
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206450-45-5 / 3-chloropropyl-methyl-bis(prop-2-enyl)silane

Standard CAS: 206450-45-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
206450-45-5
Multi CAS
No
Molecular Formula
C10H19ClSi
Molecular Weight
202.790000
Exact Mass
202.094455
SMILES
C[Si](CCCCl)(CC=C)CC=C
InChI
InChI=1S/C10H19ClSi/c1-4-8-12(3,9-5-2)10-6-7-11/h4-5H,1-2,6-10H2,3H3
InChIKey
ODDHSEMWRZIOCE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.6
Rotatable bonds
7
Molar refractivity
61.77
TPSA
0.0000

LogP / Solubility

WLOGP
4.07
MLOGP
3.58
XLogP3
4.07
Consensus LogP
3.91
Log S (ESOL)
-3.2
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.16
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.19
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
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)
-1.07

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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