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CAS 367-86-2 4-Fluoro-3-nitrobenzotrifluoride molecular structure lightbox
CAS RN: 367-86-2

4-Fluoro-3-nitrobenzotrifluoride

Product Availability

Choose a grade to view its available package options.

8 package records6 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250326 100g In stock Inquiry
Batchno.20250211 10g Out of stock Inquiry
Batchno.20250220 250g In stock Inquiry
Batchno.20250314 25g In stock Inquiry
Batchno.20260328 500g Out of stock Inquiry
Batchno.20251011 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260330 1ml In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260512 5g / 25g / 100g / 500g / 2.5kg Confirm by inquiry Shanghai, Shandong, Guangdong Inquiry
  • Product code: SSC-143926
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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: 10g, 25g, 100g, 500g
  • 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 367-86-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g >97% 0 Out of Stock Beijing Inquiry
25g >97% 0 Out of Stock Shenzhen Inquiry
100g >97% 0 Out of Stock Beijing Inquiry
500g >97% 0 Out of Stock Shanghai Inquiry

367-86-2 / 1-fluoro-2-nitro-4-(trifluoromethyl)benzene

Standard CAS: 367-86-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
367-86-2
Multi CAS
Yes
Molecular Formula
C7F4H3NO2
Molecular Weight
209.100000
Exact Mass
209.009991
InChI
InChI=1S/C7H3F4NO2/c8-5-2-1-4(7(9,10)11)3-6(5)12(13)14/h1-3H
InChIKey
HLDFCCHSOZWKAA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
38.06
TPSA
43.14

LogP / Solubility

WLOGP
2.75
MLOGP
2.42
XLogP3
2.2
Consensus LogP
2.46
Log S (ESOL)
-3.12
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.26
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.42
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)
-2.04

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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