CAS RN: 630402-22-1
1-Pentanesulfonic acid, 1,1,2,2,3,3,4,4,5,5,5-undecafluoro-, sodium salt (1:1)
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250301 | 10mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS630402-22-1
- Purity/Analytical Methods: >99.0%
630402-22-1 / sodium 1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane-1-sulfonate
Basic Information
CAS
630402-22-1
Multi CAS
No
Molecular Formula
C5F11NAO3S
Molecular Weight
372.090000
Exact Mass
371.929019
InChI
InChI=1S/C5HF11O3S.Na/c6-1(7,2(8,9)4(12,13)14)3(10,11)5(15,16)20(17,18)19;/h(H,17,18,19);/q;+1/p-1
InChIKey
ILMCRVHLQCCOBM-UHFFFAOYSA-M
Computed Properties
Structural Parameters
Heavy atom count
21
Fraction Csp3
1
Rotatable bonds
4
H-bond acceptors
3
Molar refractivity
35.54
TPSA
57.2
LogP / Solubility
WLOGP
-0.4
MLOGP
-0.33
XLogP3
-0.4
Consensus LogP
-0.38
Log S (ESOL)
-1.63
Class (ESOL)
Soluble
Log S (Ali)
-2.32
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.22
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
Low
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)
-5.28
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
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![CAS 630404-46-5 Cobalt, chloro[[2,2′-[(1S,2S)-1,2-cyclohexanediylbis[(nitrilo-κN)Methylidyne]]bis[4,6-bis(1,1-diMethylethyl)phenolato-κO]](2-)]-, (SP-5-13)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/630404-46-5.gif)
