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CAS 851042-10-9 2,7-Diamino-9,9-di-n-octylfluorene molecular structure lightbox
CAS RN: 851042-10-9

2,7-Diamino-9,9-di-n-octylfluorene

Product Availability

Choose a grade to view its available package options.

5 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250130 1g In stock Shanghai, Shandong Inquiry
Batchno.20250515 250mg In stock Shanghai Inquiry
Batchno.20260627 5g Out of stock 5-7 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260504 1g In stock Shanghai Inquiry
Batchno.20251222 250mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-193153
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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: ≥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 851042-10-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥98% 0 Out of Stock Beijing Inquiry

851042-10-9 / 9,9-dioctylfluorene-2,7-diamine

Standard CAS: 851042-10-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
851042-10-9
Multi CAS
No
Molecular Formula
C29H44N2
Molecular Weight
420.700000
Exact Mass
420.350449
InChI
InChI=1S/C29H44N2/c1-3-5-7-9-11-13-19-29(20-14-12-10-8-6-4-2)27-21-23(30)15-17-25(27)26-18-16-24(31)22-28(26)29/h15-18,21-22H,3-14,19-20,30-31H2,1-2H3
InChIKey
ODJBGRHFVFWTBO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
31
Aromatic heavy atom count
12
Fraction Csp3
0.59
Rotatable bonds
14
H-bond acceptors
2
H-bond donors
2
Molar refractivity
137.47
TPSA
52.04

LogP / Solubility

WLOGP
8.62
MLOGP
7.61
XLogP3
10.6
Consensus LogP
8.94
Log S (ESOL)
-7.24
Class (ESOL)
Insoluble
Log S (Ali)
-9.23
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.23
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
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.83

Drug-likeness / Medicinal Chemistry

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

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