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CAS 6018-19-5 Sodium 4-Aminosalicylate Dihydrate molecular structure lightbox
CAS RN: 6018-19-5

Sodium 4-Aminosalicylate Dihydrate

  • Product code: SSC-168743
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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: ≥98%
  • 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 6018-19-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥98% 0 Out of Stock Shenzhen Inquiry

6018-19-5 / sodium;4-amino-2-hydroxybenzoate;dihydrate

Standard CAS: 6018-19-5 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
6018-19-5
Multi CAS
Yes
Molecular Formula
C7H10NNAO5
Molecular Weight
211.150000
Exact Mass
211.045667
InChI
InChI=1S/C7H7NO3.Na.2H2O/c8-4-1-2-5(7(10)11)6(9)3-4;;;/h1-3,9H,8H2,(H,10,11);;2*1H2/q;+1;;/p-1
InChIKey
GMUQJDAYXZXBOT-UHFFFAOYSA-M

Physical Properties

Physical Description
Beige crystalline solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
44.08
TPSA
149.38

LogP / Solubility

WLOGP
-5.31
MLOGP
-4.67
XLogP3
-5.31
Consensus LogP
-5.1
Log S (ESOL)
1.94
Class (ESOL)
Highly soluble
Log S (Ali)
2.54
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
3.25
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)
-7.78

Drug-likeness / Medicinal Chemistry

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

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