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CAS 289-96-3 1,2,3-Triazine molecular structure lightbox
CAS RN: 289-96-3

1,2,3-Triazine

  • Product code: SSC-130790
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 0.1g, 0.25g, 1g
  • Available purity: >95%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 289-96-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 5 In Stock Beijing Inquiry
0.25g >95% 5 In Stock Hong Kong Inquiry
1g >95% 1 In Stock Shenzhen Inquiry

289-96-3 / triazine

Standard CAS: 289-96-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
289-96-3
Multi CAS
Yes
Molecular Formula
C3H3N3
Molecular Weight
81.080000
Exact Mass
81.032697
InChI
InChI=1S/C3H3N3/c1-2-4-6-5-3-1/h1-3H
InChIKey
JYEUMXHLPRZUAT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
6
Aromatic heavy atom count
6
H-bond acceptors
3
Molar refractivity
19.83
TPSA
38.67

LogP / Solubility

WLOGP
-0.13
MLOGP
-0.13
XLogP3
-0.7
Consensus LogP
-0.32
Log S (ESOL)
-1
Class (ESOL)
Soluble
Log S (Ali)
-0.13
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.08
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)
-3.31

Drug-likeness / Medicinal Chemistry

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

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