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CAS 24279-39-8 4-Amino-3,5-dichlorobenzotrifluoride molecular structure lightbox
CAS RN: 24279-39-8

4-Amino-3,5-dichlorobenzotrifluoride

Product Availability

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6 package records6 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251031 100g In stock Inquiry
Batchno.20260101 10g In stock Inquiry
Batchno.20260328 25g In stock Inquiry
Batchno.20251230 500g In stock Inquiry
Batchno.20260309 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250113 100g / 500g Confirm by inquiry Shandong Inquiry
  • Product code: SSC-118430
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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
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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 24279-39-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ＞97% 0 Out of Stock Shenzhen Inquiry

24279-39-8 / 2,6-dichloro-4-(trifluoromethyl)aniline

Standard CAS: 24279-39-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
24279-39-8
Multi CAS
No
Molecular Formula
C7H4Cl2F3N
Molecular Weight
230.010000
Exact Mass
228.967289
SMILES
C1=C(C=C(C(=C1Cl)N)Cl)C(F)(F)F
InChI
InChI=1S/C7H4Cl2F3N/c8-4-1-3(7(10,11)12)2-5(9)6(4)13/h1-2H,13H2
InChIKey
ITNMAZSPBLRJLU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.14
H-bond acceptors
1
H-bond donors
1
Molar refractivity
45.88
TPSA
26.02

LogP / Solubility

WLOGP
3.59
MLOGP
3.17
XLogP3
3.4
Consensus LogP
3.39
Log S (ESOL)
-3.87
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.04
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.14
Class (SILICOS-IT)
Slightly 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)
-1.57

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

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