CAS RN: 50-79-3
2,5-Dichlorobenzoic Acid
Product Availability
Choose a grade to view its available package options.
8 package records7 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20260116 | 100g | In stock | Inquiry |
| Batchno.20260402 | 10g | In stock | Inquiry |
| Batchno.20250503 | 1kg | In stock | Inquiry |
| Batchno.20260129 | 250g | In stock | Inquiry |
| Batchno.20250506 | 25g | In stock | Inquiry |
| Batchno.20250216 | 500g | Out of stock | Inquiry |
| Batchno.20260128 | 50g | In stock | Inquiry |
| Batchno.20250311 | 5g | In stock | Inquiry |
- Product code: SSC-156278
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 100g
- Available purity: >97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 100g | >97% | 0 Out of Stock | Hong Kong | Inquiry |
50-79-3 / 2,5-dichlorobenzoic acid
Basic Information
CAS
50-79-3
Multi CAS
Yes
Molecular Formula
C7H4CL2O2
Molecular Weight
191.010000
Exact Mass
189.958835
InChI
InChI=1S/C7H4Cl2O2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H,10,11)
InChIKey
QVTQYSFCFOGITD-UHFFFAOYSA-N
Physical Properties
Melting Point
304 to 309 °F (NTP, 1992)
Boiling Point
574 °F at 760 mmHg (NTP, 1992)
Physical Description
2,5-dichlorobenzoic acid appears as needles (from water) or white powder. (NTP, 1992)
Solid; [CAMEO] White to beige powder
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
43.42
TPSA
37.3
LogP / Solubility
WLOGP
2.69
MLOGP
2.37
XLogP3
2.8
Consensus LogP
2.62
Log S (ESOL)
-3.06
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.07
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.26
Class (SILICOS-IT)
Poorly 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)
-1.97
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
