CAS RN: 2343-89-7
Methyl 2-Fluoroacrylate (stabilized with BHT)
- Product code: SSC-113214
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 5g, 10g, 25g, 100g
- Available purity: >97%
- Inventory rows with stock: 4
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
2343-89-7 / methyl 2-fluoroprop-2-enoate
Basic Information
CAS
2343-89-7
Multi CAS
No
Molecular Formula
C4H5FO2
Molecular Weight
104.080000
Exact Mass
104.027358
SMILES
COC(=O)C(=C)F
InChI
InChI=1S/C4H5FO2/c1-3(5)4(6)7-2/h1H2,2H3
InChIKey
ZTZJVAOTIOAZGZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
Fraction Csp3
0.25
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
22.26
TPSA
26.3
LogP / Solubility
WLOGP
0.64
MLOGP
0.55
XLogP3
1
Consensus LogP
0.73
Log S (ESOL)
-0.82
Class (ESOL)
Very soluble
Log S (Ali)
-0.88
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.99
Class (SILICOS-IT)
Very 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)
-2.9
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
1.5
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