CAS RN: 60-56-0
2-Mercapto-1-methylimidazole
Product Availability
Choose a grade to view its available package options.
5 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250208 | 5g / 25g / 100g / 500g / 2.5kg | Confirm by inquiry | Shanghai, Shandong, Guangdong, Chongqing | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250517 | 100g | In stock | Shanghai | Inquiry |
| Batchno.20250729 | 25g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20260110 | 500g | In stock | Shanghai, Shenzhen, Wuhan | Inquiry |
| Batchno.20260305 | 5g | In stock | Shanghai, Shenzhen, Tianjin, Chengdu | Inquiry |
- Product code: ICTM0868
- Purity/Analytical Methods: >98.0%(T)(HPLC)
60-56-0 / 3-methyl-1H-imidazole-2-thione
Basic Information
CAS
60-56-0
Multi CAS
Yes
Molecular Formula
C4H6N2S
Molecular Weight
114.170000
Exact Mass
114.025169
InChI
InChI=1S/C4H6N2S/c1-6-3-2-5-4(6)7/h2-3H,1H3,(H,5,7)
InChIKey
PMRYVIKBURPHAH-UHFFFAOYSA-N
Physical Properties
Melting Point
143-146 °C
146-148 °C
146 °C
Boiling Point
280 °C WITH SOME DECOMP
Physical Description
Solid
Appearance
LEAFLETS FROM ALCOHOL
WHITE TO PALE BUFF, CRYSTALLINE SUBSTANCE; STARCH-LIKE IN APPEARANCE & TO TOUCH
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
7
Aromatic heavy atom count
5
Fraction Csp3
0.25
H-bond acceptors
2
H-bond donors
1
Molar refractivity
30.6
TPSA
20.72
LogP / Solubility
WLOGP
1.08
MLOGP
0.94
XLogP3
-0.3
Consensus LogP
0.57
Log S (ESOL)
-1.76
Class (ESOL)
Soluble
Log S (Ali)
-1.28
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.3
Class (SILICOS-IT)
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)
-2.65
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
