CAS RN: 30078-65-0
3-FURONITRILE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260517 | 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS30078-65-0
- Purity/Analytical Methods: >99.0%
30078-65-0 / furan-3-carbonitrile
Basic Information
CAS
30078-65-0
Multi CAS
Yes
Molecular Formula
C5H3NO
Molecular Weight
93.080000
Exact Mass
93.021464
InChI
InChI=1S/C5H3NO/c6-3-5-1-2-7-4-5/h1-2,4H
InChIKey
ZQFYJHMUAWCEBH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
Aromatic heavy atom count
5
H-bond acceptors
2
Molar refractivity
23.42
TPSA
36.93
LogP / Solubility
WLOGP
1.15
MLOGP
1
XLogP3
0.7
Consensus LogP
0.95
Log S (ESOL)
-1.67
Class (ESOL)
Soluble
Log S (Ali)
-1.15
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.22
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)
-2.47
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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