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CAS 53397-65-2 5,6,11,12-Tetradehydrodibenzo[a,e]cyclooctene molecular structure lightbox
CAS RN: 53397-65-2

5,6,11,12-Tetradehydrodibenzo[a,e]cyclooctene

Product Availability

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6 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250912 100mg Out of stock 30 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250217 100mg In stock Shanghai Inquiry
Batchno.20250924 1g In stock Shanghai, Tianjin Inquiry
Batchno.20250723 250mg In stock Shanghai Inquiry
Batchno.20251206 50mg In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20260417 5g In stock Shanghai Inquiry
  • Product code: SSC-160724
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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: ≥97%
  • 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 53397-65-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 0 Out of Stock Shanghai Inquiry

53397-65-2 / tricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-2,10-diyne

Standard CAS: 53397-65-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
53397-65-2
Multi CAS
No
Molecular Formula
C16H8
Molecular Weight
200.230000
Exact Mass
200.062600
InChI
InChI=1S/C16H8/c1-2-6-14-11-12-16-8-4-3-7-15(16)10-9-13(14)5-1/h1-8H
InChIKey
JFYLRMKUYCIWMX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
12
Molar refractivity
64.84
TPSA
0.0000

LogP / Solubility

WLOGP
2.8
MLOGP
2.46
XLogP3
4
Consensus LogP
3.09
Log S (ESOL)
-3.4
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.22
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.29
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.95

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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