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CAS 7361-28-6 ETHYL ASPARTATE molecular structure lightbox
CAS RN: 7361-28-6

ETHYL ASPARTATE

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250517 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-183028
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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: 5g
  • 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 7361-28-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Shenzhen Inquiry

7361-28-6 / (3S)-3-amino-4-ethoxy-4-oxobutanoic acid

Standard CAS: 7361-28-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
7361-28-6
Multi CAS
Yes
Molecular Formula
C6H11NO4
Molecular Weight
161.160000
Exact Mass
161.068808
InChI
InChI=1S/C6H11NO4/c1-2-11-6(10)4(7)3-5(8)9/h4H,2-3,7H2,1H3,(H,8,9)/t4-/m0/s1
InChIKey
WXFCDLWCQIARFW-BYPYZUCNSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Fraction Csp3
0.67
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
2
Molar refractivity
36.86
TPSA
89.62

LogP / Solubility

WLOGP
-0.65
MLOGP
-0.58
XLogP3
-3.2
Consensus LogP
-1.48
Log S (ESOL)
-0.17
Class (ESOL)
Very soluble
Log S (Ali)
-0.41
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.65
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.16

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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