CAS RN: 18817-29-3

5-HEXENYLTRICHLOROSILANE

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251009 25g Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS18817-29-3
  • Purity/Analytical Methods: >99.0%
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18817-29-3 / trichloro(hex-5-enyl)silane

Standard CAS: 18817-29-3 Multi CAS: No

Basic Information

CAS
18817-29-3
Multi CAS
No
Molecular Formula
C6H11Cl3Si
Molecular Weight
217.600000
Exact Mass
215.969560
SMILES
C=CCCCC[Si](Cl)(Cl)Cl
InChI
InChI=1S/C6H11Cl3Si/c1-2-3-4-5-6-10(7,8)9/h2H,1,3-6H2
InChIKey
IHYCWJYGNRZAOB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.67
Rotatable bonds
5
Molar refractivity
52.17
TPSA
0.0000

LogP / Solubility

WLOGP
4
MLOGP
3.52
XLogP3
4
Consensus LogP
3.84
Log S (ESOL)
-3.38
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.23
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.99
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)
-1.21

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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