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CAS 109574-84-7 8-Iodo-1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluorotetradecane molecular structure lightbox
CAS RN: 109574-84-7

8-Iodo-1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluorotetradecane

Product Availability

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5 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260117 100mg In stock Shanghai Inquiry
Batchno.20251202 1g In stock Shanghai Inquiry
Batchno.20260614 250mg In stock Shanghai Inquiry
Batchno.20250630 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250413 250mg Out of stock 15 business days Inquiry
  • Product code: SSC-010943
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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
  • Available purity: ≥95%
  • 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 109574-84-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

109574-84-7 / 1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluoro-8-iodotetradecane

2-Iodo-1-(perfluorohex-1-yl)octane | RefChem:473656 | 641-169-6

Standard CAS: 109574-84-7 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
109574-84-7
Multi CAS
No
Molecular Formula
C14H16F13I
Molecular Weight
558.160000
Exact Mass
558.008910
SMILES
CCCCCCC(CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)I
InChI
InChI=1S/C14H16F13I/c1-2-3-4-5-6-8(28)7-9(15,16)10(17,18)11(19,20)12(21,22)13(23,24)14(25,26)27/h8H,2-7H2,1H3
InChIKey
GVWXUPPPAHSALU-UHFFFAOYSA-N
Synonyms
2-Iodo-1-(perfluorohex-1-yl)octane RefChem:473656 641-169-6 2-Iodo-1-(perfluorohexyl)octane 1,1,1,2,2,3,3,4,4,5,5,6,6-tridecafluoro-8-iodotetradecane

Computed Properties

Structural Parameters

Heavy atom count
28
Fraction Csp3
1
Rotatable bonds
11
H-bond acceptors
13
Molar refractivity
81.97
TPSA
0.0000

LogP / Solubility

WLOGP
7.89
MLOGP
6.99
XLogP3
9.3
Consensus LogP
8.06
Log S (ESOL)
-7.54
Class (ESOL)
Insoluble
Log S (Ali)
-9.83
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.16
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.52

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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