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CAS 941-43-5 ethyl 2-methyl-1,3-dioxolane-2-propionate molecular structure lightbox
CAS RN: 941-43-5

ethyl 2-methyl-1,3-dioxolane-2-propionate

  • Product code: SSC-208654
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 941-43-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

941-43-5 / ethyl 3-(2-methyl-1,3-dioxolan-2-yl)propanoate

Standard CAS: 941-43-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
941-43-5
Multi CAS
Yes
Molecular Formula
C9H16O4
Molecular Weight
188.220000
Exact Mass
188.104859
InChI
InChI=1S/C9H16O4/c1-3-11-8(10)4-5-9(2)12-6-7-13-9/h3-7H2,1-2H3
InChIKey
PLUNGZQWVYCJBJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
0.89
Rotatable bonds
4
H-bond acceptors
4
Molar refractivity
46.18
TPSA
44.76

LogP / Solubility

WLOGP
1.09
MLOGP
0.96
XLogP3
0.6
Consensus LogP
0.88
Log S (ESOL)
-1.43
Class (ESOL)
Soluble
Log S (Ali)
-1.89
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.27
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)
-3.09

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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