CAS RN: 330562-41-9
PERFLUORO-3,6,9-TRIOXATRIDECANOIC ACID
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250426 | 1g / 5g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS330562-41-9
- Purity/Analytical Methods: >99.0%
330562-41-9 / 2,2-difluoro-2-[1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-(1,1,2,2,3,3,4,4,4-nonafluorobutoxy)ethoxy]ethoxy]acetic acid
Basic Information
CAS
330562-41-9
Multi CAS
No
Molecular Formula
C10F19HO5
Molecular Weight
562.080000
Exact Mass
561.952058
InChI
InChI=1S/C10HF19O5/c11-2(12,1(30)31)32-7(22,23)8(24,25)34-10(28,29)9(26,27)33-6(20,21)4(15,16)3(13,14)5(17,18)19/h(H,30,31)
InChIKey
GDQLSTSWOFAQNO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
34
Fraction Csp3
0.9
Rotatable bonds
11
H-bond acceptors
4
H-bond donors
1
Molar refractivity
56.52
TPSA
64.99
LogP / Solubility
WLOGP
5.51
MLOGP
4.89
XLogP3
6.4
Consensus LogP
5.6
Log S (ESOL)
-6.07
Class (ESOL)
Insoluble
Log S (Ali)
-8.15
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.21
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
Yes
Log Kp (skin permeation)
-2.24
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.56
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
1H,1H,11H,11H-PERFLUORO-3,6,9-TRIOXAUNDECANE-1,11-DIOL
- CAS RN: 330562-44-2
- Product Code: SSC-138892
-
Peramivir
- CAS RN: 330600-85-6
- Product Code: starshine_CAS330600-85-6
- Purity/Analytical method: >99.0%
-
2-CHLORO-1-[4-(4-FLUORO-PHENYL)-PIPERAZIN-1-YL]-ETHANONE
- CAS RN: 330601-48-4
- Product Code: starshine_CAS330601-48-4
- Purity/Analytical method: >99.0%
-
N4-(DIMETHYLAMINO)METHYLENE)-5′-O-(DIMETHOXYTRITYL)-2′-DEOXYGUANOSINE-3′-N,N-DIISOPROPYL (CYANOETHYL) PHOSPHORAMIDITE
- CAS RN: 330628-04-1
- Product Code: SSC-138898
-
8-chloroquinoline-2,4-dicarboxylic acid
- CAS RN: 330646-88-3
- Product Code: starshine_CAS330646-88-3
- Purity/Analytical method: >99.0%
-
(±)-2-(1H-benzimidazol-2-ylthio)propanoicacid2-[(5-bromo-2-hydroxyphenyl)methylene]hydrazide
- CAS RN: 330676-02-3
- Product Code: SSC-138911
![CAS 330601-48-4 2-CHLORO-1-[4-(4-FLUORO-PHENYL)-PIPERAZIN-1-YL]-ETHANONE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/330601-48-4.gif)
![CAS 330676-02-3 (±)-2-(1H-benzimidazol-2-ylthio)propanoicacid2-[(5-bromo-2-hydroxyphenyl)methylene]hydrazide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/330676-02-3.gif)