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CAS 18292-29-0 DIETHYLMETHYLVINYLSILANE molecular structure lightbox
CAS RN: 18292-29-0

DIETHYLMETHYLVINYLSILANE

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  • Product code: starshine_CAS18292-29-0
  • Purity/Analytical Methods: >99.0%
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18292-29-0 / ethenyl-diethyl-methylsilane

Standard CAS: 18292-29-0 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
18292-29-0
Multi CAS
No
Molecular Formula
C7H16Si
Molecular Weight
128.290000
Exact Mass
128.102127
SMILES
CC[Si](C)(CC)C=C
InChI
InChI=1S/C7H16Si/c1-5-8(4,6-2)7-3/h5H,1,6-7H2,2-4H3
InChIKey
BAVNDESSHRPRRF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.71
Rotatable bonds
3
Molar refractivity
42.78
TPSA
0.0000

LogP / Solubility

WLOGP
2.83
MLOGP
2.48
XLogP3
2.83
Consensus LogP
2.71
Log S (ESOL)
-2.22
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.66
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)
-1.49

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 Irritant
Signal
Danger
GHS Hazard Statements
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids] H315 (90.7%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (90.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (90.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501

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