2-苯乙氨基乙硫醇
TL;DR: 2-苯乙氨基乙硫醇 (CAS 6197-28-0) is a chemical compound with molecular formula C10H15NS and molecular weight 181.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-苯乙氨基乙硫醇
2-(2-phenylethylamino)ethanethiol
Also Known As: 2-Phenethylaminoethanethiol, Ethanethiol, 2-phenethylamino-, 2-[(2-phenylethyl)amino]ethanethiol, 2-(phenethylamino)ethanethiol, 2-(phenethylamino)-ethanethiol
| Molecular Formula | C10H15NS |
|---|---|
| Molecular Weight | 181.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 13.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 181.09251 |
| Heavy Atoms | 12 |
| Complexity | 100.0 |
Chemical Identifiers
| CAS Number | 6197-28-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNCCS |
| InChIKey | SWQCRWGJYVDLAO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-苯乙氨基乙硫醇 (CAS 6197-28-0), with molecular formula C10H15NS and molecular weight 181.09 g/mol. IUPAC: 2-(2-phenylethylamino)ethanethiol.
Chemical Property Profile of 2-苯乙氨基乙硫醇
Property Insights of 2-苯乙氨基乙硫醇
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-苯乙氨基乙硫醇. With a topological polar surface area (TPSA) of 13.0 Ų, 2-苯乙氨基乙硫醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-苯乙氨基乙硫醇 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-苯乙氨基乙硫醇?
The CAS number of 2-苯乙氨基乙硫醇 is 6197-28-0.
What is the molecular formula of 2-苯乙氨基乙硫醇?
The molecular formula of 2-苯乙氨基乙硫醇 is C10H15NS.
What is the molecular weight of 2-苯乙氨基乙硫醇?
The molecular weight of 2-苯乙氨基乙硫醇 is 181.09 g/mol.
Where can I buy 2-苯乙氨基乙硫醇?
You can request a quote for 2-苯乙氨基乙硫醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-苯乙氨基乙硫醇?
Yes, KEHONG BIO provides custom synthesis services for 2-苯乙氨基乙硫醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.