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CAS 202405-16-1 9-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]-2-nonanol molecular structure lightbox
CAS RN: 202405-16-1

9-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]-2-nonanol

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260506 50mg / 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS202405-16-1
  • Purity/Analytical Methods: >99.0%
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202405-16-1 / 9-[tert-butyl(dimethyl)silyl]oxynonan-2-ol

Standard CAS: 202405-16-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
202405-16-1
Multi CAS
No
Molecular Formula
C15H34O2Si
Molecular Weight
274.510000
Exact Mass
274.232807
SMILES
CC(CCCCCCCO[Si](C)(C)C(C)(C)C)O
InChI
InChI=1S/C15H34O2Si/c1-14(16)12-10-8-7-9-11-13-17-18(5,6)15(2,3)4/h14,16H,7-13H2,1-6H3
InChIKey
FKXCYXCPDXCINT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Fraction Csp3
1
Rotatable bonds
9
H-bond acceptors
2
H-bond donors
1
Molar refractivity
82.53
TPSA
29.46

LogP / Solubility

WLOGP
4.73
MLOGP
4.17
XLogP3
4.73
Consensus LogP
4.54
Log S (ESOL)
-3.93
Class (ESOL)
Poorly soluble
Log S (Ali)
-5.23
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.45
Class (SILICOS-IT)
Insoluble

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)
-1.04

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
2

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