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CAS 22029-36-3 Ethylenediamine Sulfate molecular structure lightbox
CAS RN: 22029-36-3

Ethylenediamine Sulfate

  • Product code: SSC-105961
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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: ≥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 22029-36-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥95% 0 Out of Stock Shenzhen Inquiry

22029-36-3 / ethane-1,2-diamine;sulfuric acid

Standard CAS: 22029-36-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
22029-36-3
Multi CAS
No
Molecular Formula
C2H10N2O4S
Molecular Weight
158.180000
Exact Mass
158.036128
SMILES
C(CN)N.OS(=O)(=O)O
InChI
InChI=1S/C2H8N2.H2O4S/c3-1-2-4;1-5(2,3)4/h1-4H2;(H2,1,2,3,4)
InChIKey
BNZCDZDLTIHJAC-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
4
Molar refractivity
32.29
TPSA
126.64

LogP / Solubility

WLOGP
-1.75
MLOGP
-1.54
XLogP3
-1.75
Consensus LogP
-1.68
Log S (ESOL)
0.35
Class (ESOL)
Highly soluble
Log S (Ali)
0.41
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.64
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)
-4.93

Drug-likeness / Medicinal Chemistry

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

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