CAS RN: 3420-57-3
3-Methoxyfuran
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20250824 | 1mg | Out of stock | Inquiry |
- Product code: starshine_CAS3420-57-3
- Purity/Analytical Methods: >99.0%
3420-57-3 / 3-methoxyfuran
Basic Information
CAS
3420-57-3
Multi CAS
No
Molecular Formula
C5H6O2
Molecular Weight
98.100000
Exact Mass
98.036779
InChI
InChI=1S/C5H6O2/c1-6-5-2-3-7-4-5/h2-4H,1H3
InChIKey
VMMAQHURVWNQOM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
Aromatic heavy atom count
5
Fraction Csp3
0.2
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
25.26
TPSA
22.37
LogP / Solubility
WLOGP
1.29
MLOGP
1.12
XLogP3
1
Consensus LogP
1.14
Log S (ESOL)
-1.72
Class (ESOL)
Soluble
Log S (Ali)
-1.29
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.49
Class (SILICOS-IT)
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)
-2.4
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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