CAS RN: 1719-58-0

Chlorodimethylvinylsilane

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  • Product code: ICTC1208
  • Purity/Analytical Methods: >97.0%(GC)
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1719-58-0 / chloro-ethenyl-dimethylsilane

Standard CAS: 1719-58-0 Multi CAS: No

Basic Information

CAS
1719-58-0
Multi CAS
No
Molecular Formula
C4H9ClSi
Molecular Weight
120.650000
Exact Mass
120.016205
SMILES
C[Si](C)(C=C)Cl
InChI
InChI=1S/C4H9ClSi/c1-4-6(2,3)5/h4H,1H2,2-3H3
InChIKey
XSDCTSITJJJDPY-UHFFFAOYSA-N

Physical Properties

Physical Description
Liquid Colorless or brown liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
1
Molar refractivity
33.53
TPSA
0.0000

LogP / Solubility

WLOGP
2.16
MLOGP
1.89
XLogP3
2.16
Consensus LogP
2.07
Log S (ESOL)
-1.88
Class (ESOL)
Soluble
Log S (Ali)
-2.11
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.35
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)
-1.93

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 Irritant
Signal
Danger
GHS Hazard Statements
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids] H302 (25.8%): Harmful if swallowed [Warning Acute toxicity, oral] H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H318 (10.6%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P260, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P370+P378, P403+P235, P405, and P501

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