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CAS 38002-45-8 3-Bromo-1-(trimethylsilyl)-1-propyne molecular structure lightbox
CAS RN: 38002-45-8

3-Bromo-1-(trimethylsilyl)-1-propyne

  • Product code: SSC-145445
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g, 10g, 25g, 100g, 500g
  • Available purity: >97%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 38002-45-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 4 In Stock Shanghai Inquiry
5g >97% 2 In Stock Shenzhen Inquiry
10g >97% 0 Out of Stock Hong Kong Inquiry
25g >97% 0 Out of Stock Shanghai Inquiry
100g >97% 0 Out of Stock Hong Kong Inquiry
500g >97% 0 Out of Stock Shenzhen Inquiry

38002-45-8 / 3-bromoprop-1-ynyl(trimethyl)silane

Standard CAS: 38002-45-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
38002-45-8
Multi CAS
Yes
Molecular Formula
C6H11BRSI
Molecular Weight
191.140000
Exact Mass
189.981340
InChI
InChI=1S/C6H11BrSi/c1-8(2,3)6-4-5-7/h5H2,1-3H3
InChIKey
GAPRPFRDVCCCHR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.67
Rotatable bonds
1
Molar refractivity
44.92
TPSA
0.0000

LogP / Solubility

WLOGP
2.26
MLOGP
1.99
XLogP3
2.26
Consensus LogP
2.17
Log S (ESOL)
-2.45
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.76
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.78
Class (SILICOS-IT)
Moderately 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)
-2.28

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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