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CAS 38768-08-0 Tropolone Tosylate molecular structure lightbox
CAS RN: 38768-08-0

Tropolone Tosylate

Product Availability

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250505 1g Out of stock 5-7 business days Inquiry
Batchno.20250807 25g In stock Shandong Inquiry
Batchno.20251001 5g In stock Shanghai, Shandong Inquiry
  • Product code: SSC-146375
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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: ≥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 38768-08-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥97% 0 Out of Stock Shanghai Inquiry

38768-08-0 / (7-oxocyclohepta-1,3,5-trien-1-yl) 4-methylbenzenesulfonate

Standard CAS: 38768-08-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
38768-08-0
Multi CAS
Yes
Molecular Formula
C14H12O4S
Molecular Weight
276.310000
Exact Mass
276.045630
InChI
InChI=1S/C14H12O4S/c1-11-7-9-12(10-8-11)19(16,17)18-14-6-4-2-3-5-13(14)15/h2-10H,1H3
InChIKey
AWUMFQREGHLKJB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
13
Fraction Csp3
0.07
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
71.7
TPSA
60.44

LogP / Solubility

WLOGP
2.12
MLOGP
1.88
XLogP3
3.3
Consensus LogP
2.43
Log S (ESOL)
-3.2
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.36
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.58
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)
-2.9

Drug-likeness / Medicinal Chemistry

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

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