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CAS 1558-33-4 Chloromethyl(dichloro)methylsilane molecular structure lightbox
CAS RN: 1558-33-4

Chloromethyl(dichloro)methylsilane

  • Product code: SSC-065067
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 100g
  • Available purity: ≥97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1558-33-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥97% 0 Out of Stock Beijing Inquiry

1558-33-4 / dichloro-(chloromethyl)-methylsilane

Standard CAS: 1558-33-4 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1558-33-4
Multi CAS
No
Molecular Formula
C2H5Cl3Si
Molecular Weight
163.500000
Exact Mass
161.922610
SMILES
C[Si](CCl)(Cl)Cl
InChI
InChI=1S/C2H5Cl3Si/c1-6(4,5)2-3/h2H2,1H3
InChIKey
JAYBZWYBCUJLNQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Fraction Csp3
1
Rotatable bonds
1
Molar refractivity
34.04
TPSA
0.0000

LogP / Solubility

WLOGP
2.31
MLOGP
2.03
XLogP3
2.31
Consensus LogP
2.22
Log S (ESOL)
-2.25
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.57
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.76
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)
-2.07

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 Acute Toxic Irritant
Signal
Danger
GHS Hazard Statements
H226 (85.5%): Flammable liquid and vapor [Warning Flammable liquids] H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H318 (20%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H331 (87.3%): Toxic if inhaled [Danger Acute toxicity, inhalation] H335 (80%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P271, P273, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P363, P370+P378, P403+P233, P403+P235, P405, and P501

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