甜菜碱醛
TL;DR: 甜菜碱醛 (CAS 7418-61-3) is a chemical compound with molecular formula C5H12NO+ and molecular weight 102.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甜菜碱醛
trimethyl(2-oxoethyl)azanium
Also Known As: betaine aldehyde, glycine betaine aldehyde, trimethyl(2-oxoethyl)azanium, phosphocholine, betaine-aldehyde
| Molecular Formula | C5H12NO+ |
|---|---|
| Molecular Weight | 102.09 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 102.09189 |
| Heavy Atoms | 7 |
| Complexity | 63.0 |
Chemical Identifiers
| CAS Number | 7418-61-3 |
|---|---|
| SMILES | C[N+](C)(C)CC=O |
| InChIKey | SXKNCCSPZDCRFD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甜菜碱醛 (CAS 7418-61-3), with molecular formula C5H12NO+ and molecular weight 102.09 g/mol. IUPAC: trimethyl(2-oxoethyl)azanium.
Chemical Property Profile of 甜菜碱醛
Property Insights of 甜菜碱醛
The XLogP value of -0.2 indicates that 甜菜碱醛 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 17.1 Ų, 甜菜碱醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甜菜碱醛 has 0 hydrogen bond donor(s) and 1 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 甜菜碱醛?
The CAS number of 甜菜碱醛 is 7418-61-3.
What is the molecular formula of 甜菜碱醛?
The molecular formula of 甜菜碱醛 is C5H12NO+.
What is the molecular weight of 甜菜碱醛?
The molecular weight of 甜菜碱醛 is 102.09 g/mol.
Where can I buy 甜菜碱醛?
You can request a quote for 甜菜碱醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甜菜碱醛?
Yes, KEHONG BIO provides custom synthesis services for 甜菜碱醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.