[email protected]
CAS 10193-99-4 Pentaerythritol Tetrakis(mercaptoacetate) molecular structure lightbox
CAS RN: 10193-99-4

Pentaerythritol Tetrakis(mercaptoacetate)

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20250421 100g Out of stock Inquiry
  • Product code: SSC-003040
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: 25g
  • Available purity: ≥97%
  • 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 10193-99-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥97% 0 Out of Stock Shenzhen Inquiry

10193-99-4 / [3-(2-sulfanylacetyl)oxy-2,2-bis[(2-sulfanylacetyl)oxymethyl]propyl] 2-sulfanylacetate

Pentaerythritol tetrakis(2-mercaptoacetate) | Thiocure petma | 36R0OK7GPK

Standard CAS: 10193-99-4 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
10193-99-4
Multi CAS
Yes
Molecular Formula
C13H20O8S4
Molecular Weight
432.600000
Exact Mass
432.004102
SMILES
C(C(=O)OCC(COC(=O)CS)(COC(=O)CS)COC(=O)CS)S
InChI
InChI=1S/C13H20O8S4/c14-9(1-22)18-5-13(6-19-10(15)2-23,7-20-11(16)3-24)8-21-12(17)4-25/h22-25H,1-8H2
InChIKey
RUDUCNPHDIMQCY-UHFFFAOYSA-N
Synonyms
Pentaerythritol tetrakis(2-mercaptoacetate) Thiocure petma 36R0OK7GPK Pentaerythritol tetrakis(thioglycolate) PE-TSA

Computed Properties

Structural Parameters

Heavy atom count
25
Fraction Csp3
0.69
Rotatable bonds
12
H-bond acceptors
12
H-bond donors
4
Molar refractivity
101.68
TPSA
105.2

LogP / Solubility

WLOGP
-0.14
MLOGP
-0.09
XLogP3
1.2
Consensus LogP
0.32
Log S (ESOL)
-1.64
Class (ESOL)
Soluble
Log S (Ali)
-3.01
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.8
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.45

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (93%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (93%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (90.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Customers Also Viewed

Get In Touch

Contact Us