CAS RN: 1719-57-9
Chloro(chloromethyl)dimethylsilane
Product Availability
Choose a grade to view its available package options.
3 package records2 with current stock1 grade group
- Product code: ICTC0605
- Purity/Analytical Methods: >98.0%(GC)
1719-57-9 / chloro-(chloromethyl)-dimethylsilane
Basic Information
CAS
1719-57-9
Multi CAS
No
Molecular Formula
C3H8Cl2Si
Molecular Weight
143.080000
Exact Mass
141.977232
SMILES
C[Si](C)(CCl)Cl
InChI
InChI=1S/C3H8Cl2Si/c1-6(2,5)3-4/h3H2,1-2H3
InChIKey
ITKVLPYNJQOCPW-UHFFFAOYSA-N
Physical Properties
Physical Description
Liquid
State
Liquid
Computed Properties
Structural Parameters
Heavy atom count
6
Fraction Csp3
1
Rotatable bonds
1
Molar refractivity
34.05
TPSA
0.0000
LogP / Solubility
WLOGP
2.21
MLOGP
1.94
XLogP3
2.21
Consensus LogP
2.12
Log S (ESOL)
-2.05
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.33
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.54
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)
-2.02
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 (87.3%): Highly Flammable liquid and vapor [Danger Flammable liquids]
H226 (12.7%): Flammable liquid and vapor [Warning Flammable liquids]
H302 (16.4%): Harmful if swallowed [Warning Acute toxicity, oral]
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
H318 (10.9%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P363, P370+P378, P403+P233, P403+P235, P405, and P501
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