CAS RN: 79-40-3
Rubeanic Acid
Product Availability
Choose a grade to view its available package options.
4 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260328 | 100g | In stock | Shanghai, Shandong, Chongqing | Inquiry |
| Batchno.20250814 | 1g | In stock | Shanghai, Shandong, Chongqing, Hebei | Inquiry |
| Batchno.20250413 | 25g | In stock | Shanghai, Shandong, Guangdong | Inquiry |
| Batchno.20250630 | 5g | In stock | Shanghai, Shandong, Guangdong, Hebei | Inquiry |
- Product code: SSC-188207
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: 5g
- Available purity: >97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 5g | >97% | 0 Out of Stock | Hong Kong | Inquiry |
79-40-3 / ethanedithioamide
Basic Information
CAS
79-40-3
Multi CAS
No
Molecular Formula
C2H4N2S2
Molecular Weight
120.200000
Exact Mass
119.981590
InChI
InChI=1S/C2H4N2S2/c3-1(5)2(4)6/h(H2,3,5)(H2,4,6)
InChIKey
OAEGRYMCJYIXQT-UHFFFAOYSA-N
Physical Properties
Melting Point
MP: SUBLIMES
Physical Description
Red solid; [Merck Index] Red crystalline powder
Appearance
RED CRYSTALS OR CRYSTALLINE POWDER
ORANGE-RED POWDER
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
6
H-bond acceptors
2
H-bond donors
2
Molar refractivity
33.57
TPSA
52.04
LogP / Solubility
WLOGP
-0.44
MLOGP
-0.4
XLogP3
-0.4
Consensus LogP
-0.41
Log S (ESOL)
-0.31
Class (ESOL)
Very soluble
Log S (Ali)
-0.23
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.07
Class (SILICOS-IT)
Very soluble
ADME
GI absorption
Low
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)
-3.77
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
