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CAS 26680-10-4 3,6-Dimethyl-1,4-dioxane-2,5-dione homopolymer molecular structure lightbox
CAS RN: 26680-10-4

3,6-Dimethyl-1,4-dioxane-2,5-dione homopolymer

Product Availability

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5 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260324 1g In stock Shanghai Inquiry
Batchno.20250509 250mg In stock Shanghai Inquiry
Batchno.20250318 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250425 1g In stock Shanghai, Shandong Inquiry
Batchno.20250427 5g In stock Shandong Inquiry
  • Product code: starshine_CAS26680-10-4
  • Purity/Analytical Methods: >99.0%
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26680-10-4 / 3,6-dimethyl-1,4-dioxane-2,5-dione

Standard CAS: 26680-10-4 Multi CAS: No
Basic Information Physical Properties Computed Properties

Basic Information

CAS
26680-10-4
Multi CAS
No
Molecular Formula
C6H8O4
Molecular Weight
144.120000
Exact Mass
144.042259
SMILES
CC1C(=O)OC(C(=O)O1)C
InChI
InChI=1S/C6H8O4/c1-3-5(7)10-4(2)6(8)9-3/h3-4H,1-2H3
InChIKey
JJTUDXZGHPGLLC-UHFFFAOYSA-N

Physical Properties

Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.67
H-bond acceptors
4
Molar refractivity
31.11
TPSA
52.6

LogP / Solubility

WLOGP
-0.14
MLOGP
-0.13
XLogP3
0.6
Consensus LogP
0.11
Log S (ESOL)
-0.65
Class (ESOL)
Very soluble
Log S (Ali)
-0.64
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.48
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.7

Drug-likeness / Medicinal Chemistry

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

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