CAS RN: 928-47-2
S-N-BUTYL THIOACETATE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250205 | 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-206617
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: 0.25g, 1g, 5g
- Available purity: >97%
- Inventory rows with stock: 3
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
928-47-2 / S-butyl ethanethioate
Basic Information
CAS
928-47-2
Multi CAS
Yes
Molecular Formula
C6H12OS
Molecular Weight
132.230000
Exact Mass
132.060886
InChI
InChI=1S/C6H12OS/c1-3-4-5-8-6(2)7/h3-5H2,1-2H3
InChIKey
XBHDWERUSGIZNS-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
8
Fraction Csp3
0.83
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
38.05
TPSA
17.07
LogP / Solubility
WLOGP
2.07
MLOGP
1.81
XLogP3
1.9
Consensus LogP
1.93
Log S (ESOL)
-1.76
Class (ESOL)
Soluble
Log S (Ali)
-2.14
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.59
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)
-2.06
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
