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CAS 304680-36-2 1-Methyl-3-n-octylimidazolium Hexafluorophosphate molecular structure lightbox
CAS RN: 304680-36-2

1-Methyl-3-n-octylimidazolium Hexafluorophosphate

Product Availability

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2 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251228 1g / 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong, Guangdong, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251027 5g / 25g / 100g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-134926
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 5g, 25g, 10g, 1g, 100g
  • Available purity: ≥98%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 304680-36-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥98% 5 In Stock Shanghai Inquiry
25g ≥98% 4 In Stock Beijing Inquiry
10g ≥98% 3 In Stock Beijing Inquiry
1g ≥98% 0 Out of Stock Beijing Inquiry
100g ≥98% 0 Out of Stock Beijing Inquiry

304680-36-2 / 1-methyl-3-octylimidazol-1-ium hexafluorophosphate

Standard CAS: 304680-36-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
304680-36-2
Multi CAS
No
Molecular Formula
C12F6H23N2P
Molecular Weight
340.290000
Exact Mass
340.150305
InChI
InChI=1S/C12H23N2.F6P/c1-3-4-5-6-7-8-9-14-11-10-13(2)12-14;1-7(2,3,4,5)6/h10-12H,3-9H2,1-2H3;/q+1;-1
InChIKey
GRCIJNHHTXBJAK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
5
Fraction Csp3
0.75
Rotatable bonds
7
H-bond acceptors
1
Molar refractivity
72.55
TPSA
8.81

LogP / Solubility

WLOGP
6.06
MLOGP
5.35
XLogP3
6.06
Consensus LogP
5.82
Log S (ESOL)
-5.48
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.72
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.74
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
No
Log Kp (skin permeation)
-0.5

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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