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CAS 839-90-7 Tris(2-hydroxyethyl) Isocyanurate molecular structure lightbox
CAS RN: 839-90-7

Tris(2-hydroxyethyl) Isocyanurate

Product Availability

Choose a grade to view its available package options.

5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260113 100g In stock Shanghai, Tianjin Inquiry
Batchno.20250723 1kg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260125 25g / 100g / 500g / 2.5kg / 10kg Confirm by inquiry Shanghai, Hebei, Shandong, Chongqing, Guangdong Inquiry
Batchno.20250530 500g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250516 5kg In stock Shanghai Inquiry
  • Product code: SSC-191568
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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: 500g
  • 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 839-90-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
500g ≥97% 0 Out of Stock Shanghai Inquiry

839-90-7 / 1,3,5-tris(2-hydroxyethyl)-1,3,5-triazinane-2,4,6-trione

Standard CAS: 839-90-7 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
839-90-7
Multi CAS
Yes
Molecular Formula
C9H15N3O6
Molecular Weight
261.230000
Exact Mass
261.096085
InChI
InChI=1S/C9H15N3O6/c13-4-1-10-7(16)11(2-5-14)9(18)12(3-6-15)8(10)17/h13-15H,1-6H2
InChIKey
BPXVHIRIPLPOPT-UHFFFAOYSA-N

Physical Properties

Melting Point
135 °C
Physical Description
1,3,5-tris(2-hydroxyethyl)triazine-2,4,6-trione is a white powder. (NTP, 1992) Dry Powder White solid; [HSDB] White powder
Appearance
WHITE SOLID
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.67
Rotatable bonds
6
H-bond acceptors
9
H-bond donors
3
Molar refractivity
60.48
TPSA
126.69

LogP / Solubility

WLOGP
-3.85
MLOGP
-3.38
XLogP3
-2.7
Consensus LogP
-3.31
Log S (ESOL)
1.12
Class (ESOL)
Highly soluble
Log S (Ali)
1.08
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
1.12
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)
-7.05

Drug-likeness / Medicinal Chemistry

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

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