CAS RN: 7211-54-3
(3-mercaptopropyl)ammonium chloride
Product Availability
Choose a grade to view its available package options.
3 package records3 with current stock1 grade group
- Product code: SSC-181656
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: 1g
- Available purity: ≥95%
- 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 |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
7211-54-3 / 3-aminopropane-1-thiol;hydrochloride
Basic Information
CAS
7211-54-3
Multi CAS
Yes
Molecular Formula
C3H10CLNS
Molecular Weight
127.640000
Exact Mass
127.022248
InChI
InChI=1S/C3H9NS.ClH/c4-2-1-3-5;/h5H,1-4H2;1H
InChIKey
GMEDUXHKSSWXSL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
6
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
34.77
TPSA
26.02
LogP / Solubility
WLOGP
0.69
MLOGP
0.6
XLogP3
0.69
Consensus LogP
0.66
Log S (ESOL)
-0.93
Class (ESOL)
Very soluble
Log S (Ali)
-1.1
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)
-3.01
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
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- CAS RN: 7212-53-5
- Product Code: starshine_CAS7212-53-5
- Purity/Analytical method: >99.0%
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