[email protected]
CAS 25554-84-1 2-(Ethoxythioxomethylthio)acetic acid molecular structure lightbox
CAS RN: 25554-84-1

2-(Ethoxythioxomethylthio)acetic acid

Product Availability

Choose a grade to view its available package options.

3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260411 1g In stock Inquiry
Batchno.20251003 250mg In stock Inquiry
Batchno.20260415 50mg In stock Inquiry
  • Product code: SSC-121625
GET A QUOTE
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: 0.25g, 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 25554-84-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥95% 0 Out of Stock Shanghai Inquiry
1g ≥95% 0 Out of Stock Hong Kong Inquiry

25554-84-1 / 2-ethoxycarbothioylsulfanylacetic acid

Standard CAS: 25554-84-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
25554-84-1
Multi CAS
No
Molecular Formula
C5H8O3S2
Molecular Weight
180.200000
Exact Mass
179.991486
SMILES
CCOC(=S)SCC(=O)O
InChI
InChI=1S/C5H8O3S2/c1-2-8-5(9)10-3-4(6)7/h2-3H2,1H3,(H,6,7)
InChIKey
CZLONQRTHUAGMG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
0.6
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
1
Molar refractivity
44.32
TPSA
46.53

LogP / Solubility

WLOGP
1.13
MLOGP
0.99
XLogP3
1.6
Consensus LogP
1.24
Log S (ESOL)
-1.47
Class (ESOL)
Soluble
Log S (Ali)
-1.85
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.13
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)
-3.02

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

Customers Also Viewed

Get In Touch

Contact Us