![CAS 17477-29-1 Chlorodimethylpropylsilane [Dimethylpropylsilylating Agent] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/d1590-jpgcontextbwfzdgvyfhjvb3r8mzi0njz8aw1hz2uvanblz3xoodkvagixlzg5mjk5mdyxmza5nzqvrde1otauanbnfdjlodi5mjdjnzuynjiynwfizjzlogu0mtmwyji4zgmxowzizdvmodiwotrimjk3odmzmjixzgi2ywi2mdy5nde.jpeg)
CAS RN: 17477-29-1
Chlorodimethylpropylsilane [Dimethylpropylsilylating Agent]
Product Availability
Choose a grade to view its available package options.
5 package records2 with current stock2 grade groups
- Product code: ICTD1590
- Purity/Analytical Methods: >99.0%(GC)
17477-29-1 / chloro-dimethyl-propylsilane
Basic Information
CAS
17477-29-1
Multi CAS
No
Molecular Formula
C5H13ClSi
Molecular Weight
136.690000
Exact Mass
136.047505
SMILES
CCC[Si](C)(C)Cl
InChI
InChI=1S/C5H13ClSi/c1-4-5-7(2,3)6/h4-5H2,1-3H3
InChIKey
HXVPUKPVLPTVCQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
Fraction Csp3
1
Rotatable bonds
2
Molar refractivity
38.43
TPSA
0.0000
LogP / Solubility
WLOGP
2.84
MLOGP
2.49
XLogP3
2.84
Consensus LogP
2.72
Log S (ESOL)
-2.34
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.73
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.15
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)
-1.54
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
H225 (85.7%): Highly Flammable liquid and vapor [Danger Flammable liquids]
H226 (14.3%): Flammable liquid and vapor [Warning Flammable liquids]
H290 (14.3%): May be corrosive to metals [Warning Corrosive to Metals]
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
H318 (28.6%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement Codes
P210, P233, P234, P240, P241, P242, P243, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P363, P370+P378, P390, P403+P235, P405, P406, and P501
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