CAS RN: 7245-21-8

IRON (II) METHOXIDE

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1 package records0 with current stock
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251020 10g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS7245-21-8
  • Purity/Analytical Methods: >99.0%
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7245-21-8 / iron(2+);methanolate

Standard CAS: 7245-21-8 Multi CAS: Yes

Basic Information

CAS
7245-21-8
Multi CAS
Yes
Molecular Formula
C2H6FEO2
Molecular Weight
117.910000
Exact Mass
117.971715
InChI
InChI=1S/2CH3O.Fe/c2*1-2;/h2*1H3;/q2*-1;+2
InChIKey
VAPRHKOWFRYFTF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
5
Fraction Csp3
1
H-bond acceptors
2
Molar refractivity
11.85
TPSA
46.12

LogP / Solubility

WLOGP
-2.05
MLOGP
-1.81
XLogP3
-2.05
Consensus LogP
-1.97
Log S (ESOL)
0.72
Class (ESOL)
Highly soluble
Log S (Ali)
0.95
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
1.27
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)
-4.89

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

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