![CAS 157499-19-9 Chlorodimethyl[3-(2,3,4,5,6-pentafluorophenyl)propyl]silane molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/c2700-jpgcontextbwfzdgvyfhjvb3r8mze4nzj8aw1hz2uvanblz3xomwqvagzhlzg5mjk1nzq5nzc1njyvqzi3mdauanbnfgjmzdzkmwjhndvkzmy0yzmzmzm2otqwmziwnmziywnkymfhntm5mjg2zgu1yznknzk4ytiwnzezyti5ywy1ndq.jpeg)
CAS RN: 157499-19-9
Chlorodimethyl[3-(2,3,4,5,6-pentafluorophenyl)propyl]silane
Product Availability
Choose a grade to view its available package options.
2 package records2 with current stock1 grade group
- Product code: SSC-066430
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: 5g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 5g | ≥95% | 0 Out of Stock | Shanghai | Inquiry |
157499-19-9 / chloro-dimethyl-[3-(2,3,4,5,6-pentafluorophenyl)propyl]silane
Basic Information
CAS
157499-19-9
Multi CAS
No
Molecular Formula
C11H12ClF5Si
Molecular Weight
302.740000
Exact Mass
302.031695
SMILES
C[Si](C)(CCCC1=C(C(=C(C(=C1F)F)F)F)F)Cl
InChI
InChI=1S/C11H12ClF5Si/c1-18(2,12)5-3-4-6-7(13)9(15)11(17)10(16)8(6)14/h3-5H2,1-2H3
InChIKey
OCIDTPKJLONLEN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
4
H-bond acceptors
5
Molar refractivity
62.7
TPSA
0.0000
LogP / Solubility
WLOGP
4.76
MLOGP
4.2
XLogP3
4.76
Consensus LogP
4.57
Log S (ESOL)
-4.7
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.48
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.06
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.19
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Corrosive
Signal
Danger
GHS Hazard Statements
H290 (50%): May be corrosive to metals [Warning Corrosive to Metals]
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
H412 (50%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P234, P260, P264, P264+P265, P273, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P390, P405, P406, and P501
Customers Also Viewed
-
Trimethoxy(1H,1H,2H,2H-nonafluorohexyl)silane
- CAS RN: 85877-79-8
- Product Code: SSC-194537
-
Triethoxy(1H,1H,2H,2H-nonafluorohexyl)silane
- CAS RN: 102390-98-7
- Product Code: SSC-003671
-
-
-
-
Chlorodimethylvinylsilane
- CAS RN: 1719-58-0
- Product Code: ICTC1208
- Purity/Analytical method: >97.0%(GC)
![CAS 1239602-38-0 [8-(Glycidyloxy)-n-octyl]trimethoxysilane molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/g0469-jpgcontextbwfzdgvyfhjvb3r8mzeymtz8aw1hz2uvanblz3xondavagq3lzg5mza4mtm2mdc5njyvrza0njkuanbnfdfiotzhnjnhnmfkmzm4zwrmodq1nta3otiwmdzjztrjywu2nje3ote0yjlhzdezm2fjzjcwowe3yzcxnjqyn2y.jpeg)
