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CAS 996-23-6 Calcium Glycolate molecular structure lightbox
CAS RN: 996-23-6

Calcium Glycolate

  • Product code: SSC-213269
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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: 25g
  • 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 996-23-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥95% 0 Out of Stock Shanghai Inquiry

996-23-6 / calcium bis(2-hydroxyacetate)

Standard CAS: 996-23-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
996-23-6
Multi CAS
Yes
Molecular Formula
C4H6CAO6
Molecular Weight
190.160000
Exact Mass
189.979029
InChI
InChI=1S/2C2H4O3.Ca/c2*3-1-2(4)5;/h2*3H,1H2,(H,4,5);/q;;+2/p-2
InChIKey
CHRHZFQUDFAQEQ-UHFFFAOYSA-L

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
6
H-bond donors
2
Molar refractivity
29.94
TPSA
120.72

LogP / Solubility

WLOGP
-4.92
MLOGP
-4.33
XLogP3
-4.92
Consensus LogP
-4.72
Log S (ESOL)
2.21
Class (ESOL)
Highly soluble
Log S (Ali)
2.44
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
2.95
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)
-7.38

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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