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CAS 17425-88-6 (DIISOPROPYLAMINO)TRIMETHYLSILANE molecular structure lightbox
CAS RN: 17425-88-6

(DIISOPROPYLAMINO)TRIMETHYLSILANE

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  • Product code: starshine_CAS17425-88-6
  • Purity/Analytical Methods: >99.0%
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17425-88-6 / N-propan-2-yl-N-trimethylsilylpropan-2-amine

Standard CAS: 17425-88-6 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
17425-88-6
Multi CAS
No
Molecular Formula
C9H23NSi
Molecular Weight
173.370000
Exact Mass
173.159976
SMILES
CC(C)N(C(C)C)[Si](C)(C)C
InChI
InChI=1S/C9H23NSi/c1-8(2)10(9(3)4)11(5,6)7/h8-9H,1-7H3
InChIKey
GEZQRKBBRMOCSP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
1
Molar refractivity
55.46
TPSA
3.24

LogP / Solubility

WLOGP
2.94
MLOGP
2.58
XLogP3
2.94
Consensus LogP
2.82
Log S (ESOL)
-2.57
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.1
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.59
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)
-1.69

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

Safety & Transport

Pictogram(s)
Flammable Corrosive
Signal
Danger
GHS Hazard Statements
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501

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