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CAS 17980-47-1 Triethoxy(isobutyl)silane molecular structure lightbox
CAS RN: 17980-47-1

Triethoxy(isobutyl)silane

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250620 100g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250406 1kg Out of stock Inquiry
Batchno.20251105 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260625 500g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: ICTT3734
  • Purity/Analytical Methods: >97.0%(GC)
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17980-47-1 / triethoxy(2-methylpropyl)silane

Standard CAS: 17980-47-1 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
17980-47-1
Multi CAS
No
Molecular Formula
C10H24O3Si
Molecular Weight
220.380000
Exact Mass
220.149471
SMILES
CCO[Si](CC(C)C)(OCC)OCC
InChI
InChI=1S/C10H24O3Si/c1-6-11-14(12-7-2,13-8-3)9-10(4)5/h10H,6-9H2,1-5H3
InChIKey
ALVYUZIFSCKIFP-UHFFFAOYSA-N

Physical Properties

Physical Description
Liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
14
Fraction Csp3
1
Rotatable bonds
8
H-bond acceptors
3
Molar refractivity
60.28
TPSA
27.69

LogP / Solubility

WLOGP
2.69
MLOGP
2.37
XLogP3
2.69
Consensus LogP
2.58
Log S (ESOL)
-2.37
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.31
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.29
Class (SILICOS-IT)
Slightly 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)
-2.15

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

Safety & Transport

Pictogram(s)
Irritant Corrosive
Signal
Warning Danger
GHS Hazard Statements
H315: Causes skin irritation [Warning Skin corrosion/irritation] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H314 (36.7%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement Codes
P264, P280, P302+P352, P321, P332+P317, and P362+P364 P260, P264, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P332+P317, P362+P364, P363, P405, and P501

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