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CAS 23911-25-3 Ethylenediaminetetraacetic Dianhydride molecular structure lightbox
CAS RN: 23911-25-3

Ethylenediaminetetraacetic Dianhydride

  • Product code: SSC-116829
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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: 100g
  • 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 23911-25-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥98% 0 Out of Stock Shanghai Inquiry

23911-25-3 / 4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione

Standard CAS: 23911-25-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
23911-25-3
Multi CAS
No
Molecular Formula
C10H12N2O6
Molecular Weight
256.210000
Exact Mass
256.069536
SMILES
C1C(=O)OC(=O)CN1CCN2CC(=O)OC(=O)C2
InChI
InChI=1S/C10H12N2O6/c13-7-3-11(4-8(14)17-7)1-2-12-5-9(15)18-10(16)6-12/h1-6H2
InChIKey
POLIXZIAIMAECK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Fraction Csp3
0.6
Rotatable bonds
3
H-bond acceptors
8
Molar refractivity
55.08
TPSA
93.22

LogP / Solubility

WLOGP
-2.24
MLOGP
-1.97
XLogP3
-0.7
Consensus LogP
-1.64
Log S (ESOL)
0.18
Class (ESOL)
Highly soluble
Log S (Ali)
-0.04
Class (Ali)
Very soluble
Log S (SILICOS-IT)
0.18
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.88

Drug-likeness / Medicinal Chemistry

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

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