5-(苄氧基)-2-氟-4-甲氧基苯甲醛
TL;DR: 5-(苄氧基)-2-氟-4-甲氧基苯甲醛 (CAS 959083-44-4) is a chemical compound with molecular formula C15H13FO3 and molecular weight 260.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(苄氧基)-2-氟-4-甲氧基苯甲醛
2-fluoro-4-methoxy-5-phenylmethoxybenzaldehyde
Also Known As: 5-(Benzyloxy)-2-fluoro-4-methoxybenzaldehyde, Benzaldehyde, 5-benzyloxy-2-fluoro-4-methoxy-, 2-fluoro-4-methoxy-5-phenylmethoxybenzaldehyde, 5-(Benzyloxy)-2-fluoro-4-methoxybenzaldehyde #
| Molecular Formula | C15H13FO3 |
|---|---|
| Molecular Weight | 260.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 260.08487 |
| Heavy Atoms | 19 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 959083-44-4 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)F)C=O)OCC2=CC=CC=C2 |
| InChIKey | GVJOQXLIUABUFU-UHFFFAOYSA-N |
Product Overview
5-(苄氧基)-2-氟-4-甲氧基苯甲醛 (CAS 959083-44-4), with molecular formula C15H13FO3 and molecular weight 260.08 g/mol. IUPAC: 2-fluoro-4-methoxy-5-phenylmethoxybenzaldehyde.
Chemical Property Profile of 5-(苄氧基)-2-氟-4-甲氧基苯甲醛
Property Insights of 5-(苄氧基)-2-氟-4-甲氧基苯甲醛
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(苄氧基)-2-氟-4-甲氧基苯甲醛. With a topological polar surface area (TPSA) of 35.5 Ų, 5-(苄氧基)-2-氟-4-甲氧基苯甲醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(苄氧基)-2-氟-4-甲氧基苯甲醛 has 0 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 5-(苄氧基)-2-氟-4-甲氧基苯甲醛?
The CAS number of 5-(苄氧基)-2-氟-4-甲氧基苯甲醛 is 959083-44-4.
What is the molecular formula of 5-(苄氧基)-2-氟-4-甲氧基苯甲醛?
The molecular formula of 5-(苄氧基)-2-氟-4-甲氧基苯甲醛 is C15H13FO3.
What is the molecular weight of 5-(苄氧基)-2-氟-4-甲氧基苯甲醛?
The molecular weight of 5-(苄氧基)-2-氟-4-甲氧基苯甲醛 is 260.08 g/mol.
Where can I buy 5-(苄氧基)-2-氟-4-甲氧基苯甲醛?
You can request a quote for 5-(苄氧基)-2-氟-4-甲氧基苯甲醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(苄氧基)-2-氟-4-甲氧基苯甲醛?
Yes, KEHONG BIO provides custom synthesis services for 5-(苄氧基)-2-氟-4-甲氧基苯甲醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.