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CAS 99611-53-7 Iron(II) bromide, dimethoxyethane molecular structure lightbox
CAS RN: 99611-53-7

Iron(II) bromide, dimethoxyethane

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250318 100mg In stock Shanghai Inquiry
Batchno.20260127 1g In stock Shanghai Inquiry
Batchno.20260611 250mg In stock Shanghai Inquiry
  • Product code: SSC-213274
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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: 1g
  • 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 99611-53-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞98% 0 Out of Stock Shanghai Inquiry

99611-53-7 / dibromoiron;1,2-dimethoxyethane

Standard CAS: 99611-53-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
99611-53-7
Multi CAS
Yes
Molecular Formula
C4H10BR2FEO2
Molecular Weight
305.770000
Exact Mass
305.837640
InChI
InChI=1S/C4H10O2.2BrH.Fe/c1-5-3-4-6-2;;;/h3-4H2,1-2H3;2*1H;/q;;;+2/p-2
InChIKey
AHVHKRASADUPOO-UHFFFAOYSA-L

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
41.61
TPSA
18.46

LogP / Solubility

WLOGP
1.97
MLOGP
1.74
XLogP3
1.97
Consensus LogP
1.89
Log S (ESOL)
-2.78
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.49
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.64
Class (SILICOS-IT)
Poorly 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)
-3.19

Drug-likeness / Medicinal Chemistry

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

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