CAS RN: 91324-01-5
2-(trifluoromethyl)furan-3,4-dicarboxylic acid
Product Availability
Choose a grade to view its available package options.
4 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250805 | 100mg | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20260201 | 1g | In stock | Shanghai, Shenzhen, Tianjin, Chengdu | Inquiry |
| Batchno.20260624 | 250mg | In stock | Shanghai, Shenzhen, Tianjin, Wuhan | Inquiry |
| Batchno.20250923 | 5g | Out of stock | Inquiry |
- Product code: starshine_CAS91324-01-5
- Purity/Analytical Methods: >99.0%
91324-01-5 / 2-(trifluoromethyl)furan-3,4-dicarboxylic acid
Basic Information
CAS
91324-01-5
Multi CAS
No
Molecular Formula
C7F3H3O5
Molecular Weight
224.090000
Exact Mass
223.993258
InChI
InChI=1S/C7H3F3O5/c8-7(9,10)4-3(6(13)14)2(1-15-4)5(11)12/h1H,(H,11,12)(H,13,14)
InChIKey
CQSHGAIMGIZGHB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
5
Fraction Csp3
0.14
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
37.63
TPSA
87.74
LogP / Solubility
WLOGP
1.69
MLOGP
1.49
XLogP3
1
Consensus LogP
1.39
Log S (ESOL)
-2.41
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.62
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.76
Class (SILICOS-IT)
Moderately 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)
-2.88
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
1-(9H-carbazol-9-yl)-3-morpholinopropan-2-ol
- CAS RN: 91324-16-2
- Product Code: starshine_CAS91324-16-2
- Purity/Analytical method: >99.0%
-
-
4-CHLORO-2-PHENYL-7H-PYRROLO[2,3-D]PYRIMIDINE
- CAS RN: 91331-36-1
- Product Code: SSC-204287
-
-
1H-Benzimidazol-2-amine,1-butyl-(9CI)
- CAS RN: 91337-45-0
- Product Code: starshine_CAS91337-45-0
- Purity/Analytical method: >99.0%
-
Benzimidazole, 2-(2-aminoethyl)-5,6-dimethyl- (7CI)
- CAS RN: 91337-46-1
- Product Code: SSC-204296
![CAS 91331-36-1 4-CHLORO-2-PHENYL-7H-PYRROLO[2,3-D]PYRIMIDINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/91331-36-1.gif)
