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CAS 223611-42-5 S-acetyl-PEG4-alcohol molecular structure lightbox
CAS RN: 223611-42-5

S-acetyl-PEG4-alcohol

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260612 250mg / 1g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-109040
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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: 0.1g, 0.25g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 223611-42-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 1 In Stock Shenzhen Inquiry
0.25g >95% 1 In Stock Shenzhen Inquiry
1g >95% 1 In Stock Shenzhen Inquiry
5g >95% 1 In Stock Shanghai Inquiry

223611-42-5 / S-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl] ethanethioate

Standard CAS: 223611-42-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
223611-42-5
Multi CAS
No
Molecular Formula
C10H20O5S
Molecular Weight
252.330000
Exact Mass
252.103145
SMILES
CC(=O)SCCOCCOCCOCCO
InChI
InChI=1S/C10H20O5S/c1-10(12)16-9-8-15-7-6-14-5-4-13-3-2-11/h11H,2-9H2,1H3
InChIKey
KKUXNAQDZRWEKI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Fraction Csp3
0.9
Rotatable bonds
11
H-bond acceptors
6
H-bond donors
1
Molar refractivity
62.68
TPSA
64.99

LogP / Solubility

WLOGP
0.31
MLOGP
0.28
XLogP3
-0.5
Consensus LogP
0.03
Log S (ESOL)
-0.87
Class (ESOL)
Very soluble
Log S (Ali)
-1.85
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.88
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)
-4.04

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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