[email protected]
CAS 1094759-93-9 4-chloro-5-fluoro-2-iodoaniline molecular structure lightbox
CAS RN: 1094759-93-9

4-chloro-5-fluoro-2-iodoaniline

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250331 100mg In stock Shanghai Inquiry
Batchno.20250120 1g In stock Shanghai Inquiry
Batchno.20250723 250mg In stock Shanghai Inquiry
Batchno.20251211 5g In stock Shanghai Inquiry
  • Product code: SSC-010867
GET A QUOTE
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: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1094759-93-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

1094759-93-9 / 4-chloro-5-fluoro-2-iodoaniline

4-CHLORO-5-FLUORO-2-IODOANILINE | MFCD26407029 | 4-Chloro-5-fluoro-2-iodo-phenylamine

Standard CAS: 1094759-93-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1094759-93-9
Multi CAS
No
Molecular Formula
C6H4ClFIN
Molecular Weight
271.460000
Exact Mass
270.906100
SMILES
C1=C(C(=CC(=C1F)Cl)I)N
InChI
InChI=1S/C6H4ClFIN/c7-3-1-5(9)6(10)2-4(3)8/h1-2H,10H2
InChIKey
VQKNRDMUFGHRFG-UHFFFAOYSA-N
Synonyms
4-CHLORO-5-FLUORO-2-IODOANILINE MFCD26407029 4-Chloro-5-fluoro-2-iodo-phenylamine SCHEMBL9908757 WLZ4546

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
H-bond acceptors
1
H-bond donors
1
Molar refractivity
48.54
TPSA
26.02

LogP / Solubility

WLOGP
2.67
MLOGP
2.35
XLogP3
2.6
Consensus LogP
2.54
Log S (ESOL)
-3.65
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.71
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.64
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.48

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us