![CAS 1616483-28-3 N-[2-(Methacryloyloxy)ethyl]-N,N-dimethylbutan-1-aminium Bis(trifluoromethanesulfonyl)imide molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/m2987-jpgcontextbwfzdgvyfhjvb3r8mzmwmtf8aw1hz2uvanblz3xomdkvadq2lzg5mze2mtixnjqxmjyvtti5odcuanbnfdflnmjiy2mynmnmn2ewm2nhmznjyjbizgu1n2qxy2qwyjkyzdgzzwiyoddimmm2yjkzngq2zgmxzdlhmjmwowe.jpeg)
CAS RN: 1616483-28-3
N-[2-(Methacryloyloxy)ethyl]-N,N-dimethylbutan-1-aminium Bis(trifluoromethanesulfonyl)imide
Product Availability
Choose a grade to view its available package options.
2 package records2 with current stock1 grade group
- Product code: SSC-069265
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: 1g
- Available purity: ≥97%
- 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 |
|---|---|---|---|---|
| 1g | ≥97% | 0 Out of Stock | Shanghai | Inquiry |
1616483-28-3 / bis(trifluoromethylsulfonyl)azanide;butyl-dimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]azanium
Basic Information
CAS
1616483-28-3
Multi CAS
No
Molecular Formula
C14H24F6N2O6S2
Molecular Weight
494.500000
Exact Mass
494.097998
SMILES
CCCC[N+](C)(C)CCOC(=O)C(=C)C.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
InChI
InChI=1S/C12H24NO2.C2F6NO4S2/c1-6-7-8-13(4,5)9-10-15-12(14)11(2)3;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h2,6-10H2,1,3-5H3;/q+1;-1
InChIKey
DGSFCMKXPRSGBN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
30
Fraction Csp3
0.79
Rotatable bonds
9
H-bond acceptors
6
Molar refractivity
95.83
TPSA
108.68
LogP / Solubility
WLOGP
3.04
MLOGP
2.71
XLogP3
3.04
Consensus LogP
2.93
Log S (ESOL)
-4.23
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.81
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.48
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.58
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
2.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364
Customers Also Viewed
-
1,1,1,3,3,3-Hexafluoroisopropyl Methacrylate (stabilized with MEHQ)
- CAS RN: 3063-94-3
- Product Code: ICTM0988
- Purity/Analytical method: >98.0%(GC)
-
Mono-2-(methacryloyloxy)ethyl Phthalate (stabilized with MEHQ)
- CAS RN: 27697-00-3
- Product Code: ICTM2940
- Purity/Analytical method: >90.0%(T)
-
2-(Diethylamino)ethyl Methacrylate (stabilized with MEHQ)
- CAS RN: 105-16-8
- Product Code: SSC-006768
-
2-(Trimethylsilyloxy)ethyl Methacrylate (stabilized with BHT)
- CAS RN: 17407-09-9
- Product Code: SSC-076393
-
3-[[2-(Methacryloyloxy)ethyl]dimethylammonio]propane-1-sulfonate
- CAS RN: 3637-26-1
- Product Code: SSC-143553
-
1-Ethylcyclopentyl Methacrylate (stabilized with MEHQ)
- CAS RN: 266308-58-1
- Product Code: SSC-124679
![CAS 3637-26-1 3-[[2-(Methacryloyloxy)ethyl]dimethylammonio]propane-1-sulfonate molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/m1971-jpgcontextbwfzdgvyfhjvb3r8mjgxmjv8aw1hz2uvanblz3xonzuvaguzlzg5mze0otmzndczntgvtte5nzeuanbnfdhhnwm2nju4nduyn2i3zja3mmexmdbmmtmxyzdlzjayzgzhzgflnmjhyjmxndlkytk4mzy3ymzim2fmytc1ogq.jpeg)
