CAS RN: 594-65-0
Trichloroacetamide
Product Availability
Choose a grade to view its available package options.
6 package records6 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260202 | 25g / 100g / 500g / 2.5kg | Confirm by inquiry | Shanghai, Chongqing, Shandong | Inquiry |
- Product code: SSC-167861
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: ≥98%
- 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 | ≥98% | 0 Out of Stock | Hong Kong | Inquiry |
594-65-0 / 2,2,2-trichloroacetamide
Basic Information
CAS
594-65-0
Multi CAS
Yes
Molecular Formula
C2H2CL3NO
Molecular Weight
162.400000
Exact Mass
160.920197
InChI
InChI=1S/C2H2Cl3NO/c3-2(4,5)1(6)7/h(H2,6,7)
InChIKey
UPQQXPKAYZYUKO-UHFFFAOYSA-N
Physical Properties
Physical Description
White solid
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
7
Fraction Csp3
0.5
H-bond acceptors
1
H-bond donors
1
Molar refractivity
29.48
TPSA
43.09
LogP / Solubility
WLOGP
0.84
MLOGP
0.74
XLogP3
1
Consensus LogP
0.86
Log S (ESOL)
-1.38
Class (ESOL)
Soluble
Log S (Ali)
-1.5
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.41
Class (SILICOS-IT)
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)
-3.11
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
