2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl-
TL;DR: 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl- (CAS 46738-98-1) is a chemical compound with molecular formula C12H20NO3+ and molecular weight 226.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-ethoxycarbonyl-5-methylfuran-2-yl)methyl-trimethylazanium
Also Known As: 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl-, N-(3-Carbethoxy-2-methyl-5-furanmethyl)-N,N,N-trimethylammonium, (4-ethoxycarbonyl-5-methylfuran-2-yl)methyl-trimethylazanium
| Molecular Formula | C12H20NO3+ |
|---|---|
| Molecular Weight | 226.14 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 226.14432 |
| Heavy Atoms | 16 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 46738-98-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC(=C1)C[N+](C)(C)C)C |
| InChIKey | FCULXGWQINGHAO-UHFFFAOYSA-N |
Product Overview
2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl- (CAS 46738-98-1), with molecular formula C12H20NO3+ and molecular weight 226.14 g/mol. IUPAC: (4-ethoxycarbonyl-5-methylfuran-2-yl)methyl-trimethylazanium.
Chemical Property Profile of 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl-
Property Insights of 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl-. With a topological polar surface area (TPSA) of 39.4 Ų, 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl- has 0 hydrogen bond donor(s) and 3 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-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl-?
The CAS number of 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl- is 46738-98-1.
What is the molecular formula of 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl-?
The molecular formula of 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl- is C12H20NO3+.
What is the molecular weight of 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl-?
The molecular weight of 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl- is 226.14 g/mol.
Where can I buy 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl-?
You can request a quote for 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Furanmethanaminium, 4-(ethoxycarbonyl)-N,N,N,5-tetramethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.