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CAS 1726-23-4 Tributyl Trimellitate molecular structure lightbox
CAS RN: 1726-23-4

Tributyl Trimellitate

Product Availability

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2 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260306 25ml Out of stock 5-7 business days Inquiry
Batchno.20251129 5ml In stock Shanghai, Shandong Inquiry
  • Product code: SSC-075850
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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: 25ml
  • 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 1726-23-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
25ml ≥98% 0 Out of Stock Shenzhen Inquiry

1726-23-4 / tributyl benzene-1,2,4-tricarboxylate

Standard CAS: 1726-23-4 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1726-23-4
Multi CAS
No
Molecular Formula
C21H30O6
Molecular Weight
378.500000
Exact Mass
378.204239
SMILES
CCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCC)C(=O)OCCCC
InChI
InChI=1S/C21H30O6/c1-4-7-12-25-19(22)16-10-11-17(20(23)26-13-8-5-2)18(15-16)21(24)27-14-9-6-3/h10-11,15H,4-9,12-14H2,1-3H3
InChIKey
RJIFVNWOLLIBJV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
27
Aromatic heavy atom count
6
Fraction Csp3
0.57
Rotatable bonds
12
H-bond acceptors
6
Molar refractivity
102.01
TPSA
78.9

LogP / Solubility

WLOGP
4.56
MLOGP
4.03
XLogP3
5.8
Consensus LogP
4.8
Log S (ESOL)
-4.43
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.95
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-7.34
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.79

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

GHS Hazard Statements
Not Classified Reported as not meeting GHS hazard criteria by 1 of 1 companies. For more detailed information, please visit ECHA C&L website.

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