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CAS 1158844-76-8 2,9,9-triphenyl-9H-fluorene molecular structure lightbox
CAS RN: 1158844-76-8

2,9,9-triphenyl-9H-fluorene

Product Availability

Choose a grade to view its available package options.

6 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260326 10g In stock Shanghai Inquiry
Batchno.20250305 1g In stock Shanghai Inquiry
Batchno.20250703 250mg In stock Shanghai Inquiry
Batchno.20250522 25g In stock Shanghai Inquiry
Batchno.20250623 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260114 1g / 5g / 25g Out of stock 5-7 business days Inquiry
  • Product code: SSC-015691
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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 1158844-76-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

1158844-76-8 / 2,9,9-triphenylfluorene

2,9,9-Triphenyl-9H-fluorene | MFCD34167349 | 2,9,9-triphenylfluorene

Standard CAS: 1158844-76-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1158844-76-8
Multi CAS
No
Molecular Formula
C31H22
Molecular Weight
394.500000
Exact Mass
394.172151
SMILES
C1=CC=C(C=C1)C2=CC3=C(C=C2)C4=CC=CC=C4C3(C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C31H22/c1-4-12-23(13-5-1)24-20-21-28-27-18-10-11-19-29(27)31(30(28)22-24,25-14-6-2-7-15-25)26-16-8-3-9-17-26/h1-22H
InChIKey
GOENSWLRVPAREA-UHFFFAOYSA-N
Synonyms
2,9,9-Triphenyl-9H-fluorene MFCD34167349 2,9,9-triphenylfluorene starbld0010555 SCHEMBL18204437

Computed Properties

Structural Parameters

Heavy atom count
31
Aromatic heavy atom count
30
Fraction Csp3
0.03
Rotatable bonds
3
Molar refractivity
129.18
TPSA
0.0000

LogP / Solubility

WLOGP
7.72
MLOGP
6.81
XLogP3
8.3
Consensus LogP
7.61
Log S (ESOL)
-7.67
Class (ESOL)
Insoluble
Log S (Ali)
-8.37
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.99
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)
0.35

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4

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