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CAS 76782-82-6 tert-Butyldimethyl(2-propynyloxy)silane molecular structure lightbox
CAS RN: 76782-82-6

tert-Butyldimethyl(2-propynyloxy)silane

  • Product code: SSC-186193
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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: 5g, 10g, 25g, 100g, 500g, 1000g
  • Available purity: >98%
  • Inventory rows with stock: 4
  • 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 76782-82-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >98% 5 In Stock Hong Kong Inquiry
10g >98% 5 In Stock Hong Kong Inquiry
25g >98% 5 In Stock Shanghai Inquiry
100g >98% 5 In Stock Shanghai Inquiry
500g >98% 0 Out of Stock Beijing Inquiry
1000g >98% 0 Out of Stock Beijing Inquiry

76782-82-6 / tert-butyl-dimethyl-prop-2-ynoxysilane

Standard CAS: 76782-82-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
76782-82-6
Multi CAS
Yes
Molecular Formula
C9H18OSi
Molecular Weight
170.320000
Exact Mass
170.112692
InChI
InChI=1S/C9H18OSi/c1-7-8-10-11(5,6)9(2,3)4/h1H,8H2,2-6H3
InChIKey
ZYDKYFIXEYSNPO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.78
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
51.98
TPSA
9.23

LogP / Solubility

WLOGP
2.64
MLOGP
2.32
XLogP3
2.64
Consensus LogP
2.53
Log S (ESOL)
-2.43
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.86
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.2
Class (SILICOS-IT)
Poorly 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)
-1.88

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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