CAS RN: 86273-46-3
2-Propenoic acid, 2-[2-(ethenyloxy)ethoxy]ethyl ester
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20250920 |
100g / 500g / 1kg |
Out of stock |
5-7 business days | Inquiry |
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Product code:
starshine_CAS86273-46-3
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Purity/Analytical Methods:
>99.0%
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86273-46-3 / 2-(2-ethenoxyethoxy)ethyl prop-2-enoate
Standard CAS: 86273-46-3
Multi CAS: No
Basic Information
CAS
86273-46-3
Multi CAS
No
Molecular Formula
C9H14O4
Molecular Weight
186.200000
Exact Mass
186.089209
InChI
InChI=1S/C9H14O4/c1-3-9(10)13-8-7-12-6-5-11-4-2/h3-4H,1-2,5-8H2
InChIKey
URQQDYIVGXOEDA-UHFFFAOYSA-N
Physical Properties
Physical Description
Water or Solvent Wet Solid; Liquid
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
13
Fraction Csp3
0.44
Rotatable bonds
8
H-bond acceptors
4
Molar refractivity
48.12
TPSA
44.76
LogP / Solubility
WLOGP
0.89
MLOGP
0.78
XLogP3
1.2
Consensus LogP
0.96
Log S (ESOL)
-1.03
Class (ESOL)
Soluble
Log S (Ali)
-1.73
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.57
Class (SILICOS-IT)
Moderately 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)
-3.22
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