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CAS 827-15-6 Pentafluoroiodobenzene (stabilized with Copper chip) molecular structure lightbox
CAS RN: 827-15-6

Pentafluoroiodobenzene (stabilized with Copper chip)

  • Product code: SSC-190751
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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: 1g, 5g, 10g, 25g
  • Available purity: >98%
  • 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 827-15-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >98% 0 Out of Stock Beijing Inquiry
5g >98% 0 Out of Stock Hong Kong Inquiry
10g >98% 0 Out of Stock Beijing Inquiry
25g >98% 0 Out of Stock Shenzhen Inquiry

827-15-6 / 1,2,3,4,5-pentafluoro-6-iodobenzene

Standard CAS: 827-15-6 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
827-15-6
Multi CAS
Yes
Molecular Formula
C6F5I
Molecular Weight
293.960000
Exact Mass
293.896490
InChI
InChI=1S/C6F5I/c7-1-2(8)4(10)6(12)5(11)3(1)9
InChIKey
OPYHNLNYCRZOGY-UHFFFAOYSA-N

Physical Properties

Physical Description
Colorless liquid
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
H-bond acceptors
5
Molar refractivity
38.95
TPSA
0.0000

LogP / Solubility

WLOGP
2.99
MLOGP
2.64
XLogP3
3.1
Consensus LogP
2.91
Log S (ESOL)
-3.91
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.13
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.05
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)
-2.39

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

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