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CAS 928783-87-3 2-FLUORO-5-IODOBENZOTRIFLUORIDE molecular structure lightbox
CAS RN: 928783-87-3

2-FLUORO-5-IODOBENZOTRIFLUORIDE

Product Availability

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260601 1g In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20260411 250mg In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20251028 25g Out of stock Inquiry
Batchno.20260228 5g In stock Tianjin Inquiry
  • Product code: SSC-206769
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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: 5g
  • 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 928783-87-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shanghai Inquiry

928783-87-3 / 1-chloro-2-fluoro-5-iodo-3-(trifluoromethyl)benzene

Standard CAS: 928783-87-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
928783-87-3
Multi CAS
Yes
Molecular Formula
C7H2CLF4I
Molecular Weight
324.440000
Exact Mass
323.882590
InChI
InChI=1S/C7H2ClF4I/c8-5-2-3(13)1-4(6(5)9)7(10,11)12/h1-2H
InChIKey
BLTVLGYWOQCAIF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.14
H-bond acceptors
4
Molar refractivity
49.13
TPSA
0.0000

LogP / Solubility

WLOGP
4.1
MLOGP
3.63
XLogP3
4.2
Consensus LogP
3.98
Log S (ESOL)
-4.78
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.18
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.17
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.79

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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