CAS RN: 870196-83-1
2-Cyano-2-propyl Dodecyl Trithiocarbonate
Product Availability
Choose a grade to view its available package options.
9 package records8 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250323 | 100g | In stock | Shandong | Inquiry |
| Batchno.20260323 | 1g | In stock | Shanghai, Shandong, Guangdong, Hebei | Inquiry |
| Batchno.20260602 | 1g | In stock | Shanghai, Shenzhen, Tianjin | Inquiry |
| Batchno.20260612 | 250mg | In stock | Shanghai, Shandong | Inquiry |
| Batchno.20251111 | 250mg | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250613 | 25g | In stock | Shanghai, Shandong, Hebei | Inquiry |
| Batchno.20250919 | 25g | Out of stock | Inquiry | |
| Batchno.20260610 | 5g | In stock | Shanghai | Inquiry |
| Batchno.20260602 | 5g | In stock | Shanghai, Shenzhen | Inquiry |
- Product code: SSC-196470
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, 10g, 5g
- Available purity: >97%
- Inventory rows with stock: 4
- 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.
870196-83-1 / 2-dodecylsulfanylcarbothioylsulfanyl-2-methylpropanenitrile
Basic Information
CAS
870196-83-1
Multi CAS
No
Molecular Formula
C17H31NS3
Molecular Weight
345.600000
Exact Mass
345.161864
InChI
InChI=1S/C17H31NS3/c1-4-5-6-7-8-9-10-11-12-13-14-20-16(19)21-17(2,3)15-18/h4-14H2,1-3H3
InChIKey
QSVOWVXHKOQYIP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
21
Fraction Csp3
0.88
Rotatable bonds
12
H-bond acceptors
4
Molar refractivity
104.18
TPSA
23.79
LogP / Solubility
WLOGP
6.96
MLOGP
6.14
XLogP3
8.2
Consensus LogP
7.1
Log S (ESOL)
-5.58
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.42
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.12
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
0.11
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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