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CAS 32760-80-8 (Cumene)cyclopentadienyliron(II) Hexafluorophosphate molecular structure lightbox
CAS RN: 32760-80-8

(Cumene)cyclopentadienyliron(II) Hexafluorophosphate

Product Availability

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250526 1g In stock Shanghai Inquiry
Batchno.20250103 25g Out of stock Inquiry
Batchno.20250706 5g In stock Shanghai Inquiry
  • Product code: SSC-138450
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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: ≥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 32760-80-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Beijing Inquiry

32760-80-8 / cumene;cyclopenta-1,3-diene;iron(2+);hexafluorophosphate

Standard CAS: 32760-80-8 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
32760-80-8
Multi CAS
Yes
Molecular Formula
C14H17F6FEP
Molecular Weight
386.090000
Exact Mass
386.032142
InChI
InChI=1S/C9H12.C5H5.F6P.Fe/c1-8(2)9-6-4-3-5-7-9;1-2-4-5-3-1;1-7(2,3,4,5)6;/h3-8H,1-2H3;1-5H;;/q;2*-1;+2
InChIKey
AGOCNVHYNVDYAJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
22
Aromatic heavy atom count
11
Fraction Csp3
0.21
Rotatable bonds
1
H-bond acceptors
8
Molar refractivity
76.13
TPSA
0.0000

LogP / Solubility

WLOGP
7.6
MLOGP
6.71
XLogP3
7.6
Consensus LogP
7.3
Log S (ESOL)
-7.32
Class (ESOL)
Insoluble
Log S (Ali)
-8.21
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.59
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.32

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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