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CAS 65423-56-5 1-BROMO-3-(TERT-BUTYLDIMETHYLSILOXY)BENZENE molecular structure lightbox
CAS RN: 65423-56-5

1-BROMO-3-(TERT-BUTYLDIMETHYLSILOXY)BENZENE

  • Product code: SSC-175094
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ≥97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 65423-56-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥97% 0 Out of Stock Beijing Inquiry

65423-56-5 / (3-bromophenoxy)-tert-butyl-dimethylsilane

Standard CAS: 65423-56-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
65423-56-5
Multi CAS
No
Molecular Formula
C12H19BROSI
Molecular Weight
287.270000
Exact Mass
286.038850
InChI
InChI=1S/C12H19BrOSi/c1-12(2,3)15(4,5)14-11-8-6-7-10(13)9-11/h6-9H,1-5H3
InChIKey
BFRHMVJJJGUHDI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
71.97
TPSA
9.23

LogP / Solubility

WLOGP
4.83
MLOGP
4.26
XLogP3
4.83
Consensus LogP
4.64
Log S (ESOL)
-4.83
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.41
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.78
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)
-1.04

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
1.5

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