CAS RN: 121-27-7
2-Amino-4,4′-dichlorodiphenyl Ether
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250705 | 250mg / 1g / 5g / 25g | Confirm by inquiry | Shanghai, Shandong | Inquiry |
- Product code: SSC-022334
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: 5g
- 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 |
|---|---|---|---|---|
| 5g | ＞97% | 0 Out of Stock | Shanghai | Inquiry |
121-27-7 / 5-chloro-2-(4-chlorophenoxy)aniline
5-Chloro-2-(4-chlorophenoxy)aniline | 2-Amino-4,4'-dichlorodiphenyl ether | Benzenamine, 5-chloro-2-(4-chlorophenoxy)-
Basic Information
CAS
121-27-7
Multi CAS
Yes
Molecular Formula
C12H9Cl2NO
Molecular Weight
254.110000
Exact Mass
253.006119
SMILES
C1=CC(=CC=C1OC2=C(C=C(C=C2)Cl)N)Cl
InChI
InChI=1S/C12H9Cl2NO/c13-8-1-4-10(5-2-8)16-12-6-3-9(14)7-11(12)15/h1-7H,15H2
InChIKey
WLJSUJOESWTGEX-UHFFFAOYSA-N
Synonyms
5-Chloro-2-(4-chlorophenoxy)aniline
2-Amino-4,4'-dichlorodiphenyl ether
Benzenamine, 5-chloro-2-(4-chlorophenoxy)-
Fast Red FR base
5-Chloro-2-(p-chlorophenoxy)aniline
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
12
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
67.39
TPSA
35.25
LogP / Solubility
WLOGP
4.37
MLOGP
3.85
XLogP3
4
Consensus LogP
4.07
Log S (ESOL)
-4.59
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.8
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.18
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.17
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264+P265, P280, P305+P351+P338, and P337+P317
