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CAS 4405-13-4 GLYOXAL HYDRATE TRIMER molecular structure lightbox
CAS RN: 4405-13-4

GLYOXAL HYDRATE TRIMER

Product Availability

Available package options are listed below.

1 package records0 with current stock
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260116 50mg / 250mg / 1g Out of stock 30 business days Inquiry
  • Product code: SSC-152111
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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: ≥95%
  • 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 4405-13-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

4405-13-4 / 2,3,4a,6,7,8a-hexahydro-[1,4]dioxino[2,3-b][1,4]dioxine-2,3,6,7-tetrol

Standard CAS: 4405-13-4 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
4405-13-4
Multi CAS
Yes
Molecular Formula
C6H10O8
Molecular Weight
210.140000
Exact Mass
210.037567
InChI
InChI=1S/C6H10O8/c7-1-2(8)12-6-5(11-1)13-3(9)4(10)14-6/h1-10H
InChIKey
BDSPTFQIOAEIII-UHFFFAOYSA-N

Physical Properties

Physical Description
Glyoxal trimeric dihydrate is a white powder. (NTP, 1992)
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
14
Fraction Csp3
1
H-bond acceptors
8
H-bond donors
4
Molar refractivity
35.94
TPSA
117.84

LogP / Solubility

WLOGP
-2.99
MLOGP
-2.63
XLogP3
-2.6
Consensus LogP
-2.74
Log S (ESOL)
0.74
Class (ESOL)
Highly soluble
Log S (Ali)
0.88
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
1.46
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)
-6.13

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5

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