CAS RN: 87407-12-3
3-(Trifluoromethyl)pyridine-2-carboxylic Acid
Product Availability
Choose a grade to view its available package options.
7 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251023 | 100g | In stock | Shanghai | Inquiry |
| Batchno.20260317 | 10g | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20260415 | 1g | In stock | Shanghai, Tianjin, Chengdu | Inquiry |
| Batchno.20250308 | 1g / 5g / 25g / 100g | Confirm by inquiry | Shanghai | Inquiry |
| Batchno.20250920 | 25g | In stock | Shanghai | Inquiry |
| Batchno.20251027 | 500g | Out of stock | Inquiry | |
| Batchno.20251116 | 5g | In stock | Shanghai, Shenzhen | Inquiry |
- Product code: SSC-197306
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 1g, 5g, 10g, 25g
- Available purity: ≥97%
- Inventory rows with stock: 1
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
87407-12-3 / 3-(trifluoromethyl)pyridine-2-carboxylic acid
Basic Information
CAS
87407-12-3
Multi CAS
No
Molecular Formula
C7F3H4NO2
Molecular Weight
191.110000
Exact Mass
191.019413
InChI
InChI=1S/C7H4F3NO2/c8-7(9,10)4-2-1-3-11-5(4)6(12)13/h1-3H,(H,12,13)
InChIKey
DMWLBOPLZYJGPT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
36.2
TPSA
50.19
LogP / Solubility
WLOGP
1.8
MLOGP
1.58
XLogP3
1.6
Consensus LogP
1.66
Log S (ESOL)
-2.43
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.43
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.52
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
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)
-2.61
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
