2-Hydroxyethyl 5-(phenylmethyl)furoate
TL;DR: 2-Hydroxyethyl 5-(phenylmethyl)furoate (CAS 68084-01-5) is a chemical compound with molecular formula C14H14O4 and molecular weight 246.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyethyl 5-benzylfuran-3-carboxylate
Also Known As: Hydroxyethyl 5-benzyl-3-furoate, 2-Hydroxyethyl 5-(phenylmethyl)furoate, 2-hydroxyethyl 5-benzylfuran-3-carboxylate, 3-Furancarboxylic acid, 5-(phenylmethyl)-, 2-hydroxyethyl ester, 2-HYDROXYETHYL 5-(PHENYLMETHYL)-3-FURANCARBOXYLATE
| Molecular Formula | C14H14O4 |
|---|---|
| Molecular Weight | 246.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 59.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 246.0892 |
| Heavy Atoms | 18 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 68084-01-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=CC(=CO2)C(=O)OCCO |
| InChIKey | KMKHHIPWSMEPRR-UHFFFAOYSA-N |
Product Overview
2-Hydroxyethyl 5-(phenylmethyl)furoate (CAS 68084-01-5), with molecular formula C14H14O4 and molecular weight 246.09 g/mol. IUPAC: 2-hydroxyethyl 5-benzylfuran-3-carboxylate.
Chemical Property Profile of 2-Hydroxyethyl 5-(phenylmethyl)furoate
Property Insights of 2-Hydroxyethyl 5-(phenylmethyl)furoate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxyethyl 5-(phenylmethyl)furoate. With a topological polar surface area (TPSA) of 59.7 Ų, 2-Hydroxyethyl 5-(phenylmethyl)furoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxyethyl 5-(phenylmethyl)furoate 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 2-Hydroxyethyl 5-(phenylmethyl)furoate?
The CAS number of 2-Hydroxyethyl 5-(phenylmethyl)furoate is 68084-01-5.
What is the molecular formula of 2-Hydroxyethyl 5-(phenylmethyl)furoate?
The molecular formula of 2-Hydroxyethyl 5-(phenylmethyl)furoate is C14H14O4.
What is the molecular weight of 2-Hydroxyethyl 5-(phenylmethyl)furoate?
The molecular weight of 2-Hydroxyethyl 5-(phenylmethyl)furoate is 246.09 g/mol.
Where can I buy 2-Hydroxyethyl 5-(phenylmethyl)furoate?
You can request a quote for 2-Hydroxyethyl 5-(phenylmethyl)furoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxyethyl 5-(phenylmethyl)furoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxyethyl 5-(phenylmethyl)furoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.