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CAS 22830-45-1 Iron(II) Gluconate Hydrate molecular structure lightbox
CAS RN: 22830-45-1

Iron(II) Gluconate Hydrate

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250708 100g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251115 1kg In stock Wuhan Inquiry
Batchno.20250426 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260225 500g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-111169
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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 22830-45-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
500g ＞97% 0 Out of Stock Shenzhen Inquiry

22830-45-1 / iron(2+);bis((2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate);dihydrate

Standard CAS: 22830-45-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
22830-45-1
Multi CAS
No
Molecular Formula
C12H26FeO16
Molecular Weight
482.170000
Exact Mass
482.057020
SMILES
C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.O.O.[Fe+2]
InChI
InChI=1S/2C6H12O7.Fe.2H2O/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;;;/h2*2-5,7-11H,1H2,(H,12,13);;2*1H2/q;;+2;;/p-2/t2*2-,3-,4+,5-;;;/m11.../s1
InChIKey
OKGNXSFAYMSVNN-SYAJEJNSSA-L

Computed Properties

Structural Parameters

Heavy atom count
29
Fraction Csp3
0.83
Rotatable bonds
10
H-bond acceptors
14
H-bond donors
10
Molar refractivity
79.47
TPSA
345.56

LogP / Solubility

WLOGP
-11.31
MLOGP
-9.92
XLogP3
-11.31
Consensus LogP
-10.85
Log S (ESOL)
4.95
Class (ESOL)
Highly soluble
Log S (Ali)
4.65
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
5.39
Class (SILICOS-IT)
Highly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-13.69

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
6.5

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