(E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate
TL;DR: (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate (CAS 468072-73-3) is a chemical compound with molecular formula C10H13NO3 and molecular weight 195.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-3-(furan-2-ylmethylamino)but-2-enoate
Also Known As: Methyl 3-(2-furylmethylamino)but-2-enoate, methyl (E)-3-(furan-2-ylmethylamino)but-2-enoate, (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate, METHYL (2E)-3-[(FURAN-2-YLMETHYL)AMINO]BUT-2-ENOATE
| Molecular Formula | C10H13NO3 |
|---|---|
| Molecular Weight | 195.09 g/mol |
| LogP | 1.446 |
| Topological Polar Surface Area | 51.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 195.08954 |
| Heavy Atoms | 14 |
| Complexity | 314.11792 |
Chemical Identifiers
| CAS Number | 468072-73-3 |
|---|---|
| SMILES | C/C(=C\C(=O)OC)/NCC1=CC=CO1 |
Product Overview
(E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate (CAS 468072-73-3), with molecular formula C10H13NO3 and molecular weight 195.09 g/mol. IUPAC: methyl (E)-3-(furan-2-ylmethylamino)but-2-enoate.
Chemical Property Profile of (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate
Property Insights of (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate
The XLogP value of 1.446 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate. With a topological polar surface area (TPSA) of 51.47 Ų, (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate has 1 hydrogen bond donor(s) and 4 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 (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate?
The CAS number of (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate is 468072-73-3.
What is the molecular formula of (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate?
The molecular formula of (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate is C10H13NO3.
What is the molecular weight of (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate?
The molecular weight of (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate is 195.09 g/mol.
Where can I buy (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate?
You can request a quote for (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for (E)-methyl 3-((furan-2-ylmethyl)amino)but-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.