CAS RN: 38962-61-7
5-Amino-2-Fluoro Benzene Sulfonic Acid
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.20260502 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS38962-61-7
- Purity/Analytical Methods: >99.0%
38962-61-7 / 5-amino-2-fluorobenzenesulfonic acid
Basic Information
CAS
38962-61-7
Multi CAS
No
Molecular Formula
C6FH6NO3S
Molecular Weight
191.180000
Exact Mass
191.005242
InChI
InChI=1S/C6H6FNO3S/c7-5-2-1-4(8)3-6(5)12(9,10)11/h1-3H,8H2,(H,9,10,11)
InChIKey
JXRZCHPTZXGPTD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
40.63
TPSA
80.39
LogP / Solubility
WLOGP
0.65
MLOGP
0.57
XLogP3
0.1
Consensus LogP
0.44
Log S (ESOL)
-1.74
Class (ESOL)
Soluble
Log S (Ali)
-1.6
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.57
Class (SILICOS-IT)
Soluble
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
No
Log Kp (skin permeation)
-3.42
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
Customers Also Viewed
-
TRANS-RESVERATROL 4′-O-BETA-D-GLUCURONIDE
- CAS RN: 38963-95-0
- Product Code: starshine_CAS38963-95-0
- Purity/Analytical method: >99.0%
-
-
ERIODICTYOL-7-GLUCOSIDE
- CAS RN: 38965-51-4
- Product Code: starshine_CAS38965-51-4
- Purity/Analytical method: >99.0%
-
APHIDICOLIN
- CAS RN: 38966-21-1
- Product Code: starshine_CAS38966-21-1
- Purity/Analytical method: >99.0%
-
β-D-Glucopyranoside, 4-[(1E)-2-(3,5-dimethoxyphenyl)ethenyl]phenyl
- CAS RN: 38967-99-6
- Product Code: starshine_CAS38967-99-6
- Purity/Analytical method: >99.0%
-
2′-O-methylperlatolic acid
- CAS RN: 38968-07-9
- Product Code: starshine_CAS38968-07-9
- Purity/Analytical method: >99.0%
![CAS 38967-99-6 β-D-Glucopyranoside, 4-[(1E)-2-(3,5-dimethoxyphenyl)ethenyl]phenyl molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/38967-99-6.gif)
