砷甜菜鹼
TL;DR: 砷甜菜鹼 (CAS 64436-13-1) is a chemical compound with molecular formula C5H11AsO2 and molecular weight 178.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
砷甜菜鹼
2-trimethylarsoniumylacetate
Also Known As: ARSENOBETAINE, Arsenobetaine in water, 2-trimethylarsoniumylacetate, Arsenobetaine monohydrate, 2-(Trimethylarsonio)acetate
| Molecular Formula | C5H11AsO2 |
|---|---|
| Molecular Weight | 178.00 g/mol |
| LogP | 0.07 |
| Topological Polar Surface Area | 40.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.9975 |
| Heavy Atoms | 8 |
| Complexity | 87.0 |
| Melting Point | 204 - 210 °C |
Chemical Identifiers
| CAS Number | 64436-13-1 |
|---|---|
| SMILES | C[As+](C)(C)CC(=O)[O-] |
| InChIKey | SPTHHTGLGVZZRH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
砷甜菜鹼 (CAS 64436-13-1), with molecular formula C5H11AsO2 and molecular weight 178.00 g/mol. IUPAC: 2-trimethylarsoniumylacetate.
Chemical Property Profile of 砷甜菜鹼
Property Insights of 砷甜菜鹼
The XLogP value of 0.07 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 砷甜菜鹼. With a topological polar surface area (TPSA) of 40.1 Ų, 砷甜菜鹼 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 砷甜菜鹼 has 0 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 砷甜菜鹼?
The CAS number of 砷甜菜鹼 is 64436-13-1.
What is the molecular formula of 砷甜菜鹼?
The molecular formula of 砷甜菜鹼 is C5H11AsO2.
What is the molecular weight of 砷甜菜鹼?
The molecular weight of 砷甜菜鹼 is 178.00 g/mol.
Where can I buy 砷甜菜鹼?
You can request a quote for 砷甜菜鹼 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 砷甜菜鹼?
Yes, KEHONG BIO provides custom synthesis services for 砷甜菜鹼 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.