CAS RN: 60682-94-2
2-ethoxyethyl chloroacetate
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.20250314 | 100mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS60682-94-2
- Purity/Analytical Methods: >99.0%
60682-94-2 / 2-ethoxyethyl 2-chloroacetate
Basic Information
CAS
60682-94-2
Multi CAS
Yes
Molecular Formula
C6H11CLO3
Molecular Weight
166.600000
Exact Mass
166.039672
InChI
InChI=1S/C6H11ClO3/c1-2-9-3-4-10-6(8)5-7/h2-5H2,1H3
InChIKey
KPAIAQWSRMSXDB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
0.83
Rotatable bonds
5
H-bond acceptors
3
Molar refractivity
38.17
TPSA
35.53
LogP / Solubility
WLOGP
0.8
MLOGP
0.7
XLogP3
1
Consensus LogP
0.83
Log S (ESOL)
-1.05
Class (ESOL)
Soluble
Log S (Ali)
-1.51
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.01
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)
-3.16
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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