5-(2-甲酰基-3-羟基苯氧基)戊酸
TL;DR: 5-(2-甲酰基-3-羟基苯氧基)戊酸 (CAS 77858-21-0) is a chemical compound with molecular formula C12H14O5 and molecular weight 238.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-甲酰基-3-羟基苯氧基)戊酸
5-(2-formyl-3-hydroxyphenoxy)pentanoic acid
Also Known As: Velaresol, velaresolum, 5-(2-formyl-3-hydroxyphenoxy)pentanoic acid, Velaresol?, Velaresol [BAN:INN]
| Molecular Formula | C12H14O5 |
|---|---|
| Molecular Weight | 238.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 238.08412 |
| Heavy Atoms | 17 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 77858-21-0 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)OCCCCC(=O)O)C=O)O |
| InChIKey | NSUDGNLOXMLAEB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(2-甲酰基-3-羟基苯氧基)戊酸 (CAS 77858-21-0), with molecular formula C12H14O5 and molecular weight 238.08 g/mol. IUPAC: 5-(2-formyl-3-hydroxyphenoxy)pentanoic acid.
Chemical Property Profile of 5-(2-甲酰基-3-羟基苯氧基)戊酸
Property Insights of 5-(2-甲酰基-3-羟基苯氧基)戊酸
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-甲酰基-3-羟基苯氧基)戊酸. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-甲酰基-3-羟基苯氧基)戊酸. Following Lipinski's Rule of Five, 5-(2-甲酰基-3-羟基苯氧基)戊酸 has 2 hydrogen bond donor(s) and 5 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-(2-甲酰基-3-羟基苯氧基)戊酸?
The CAS number of 5-(2-甲酰基-3-羟基苯氧基)戊酸 is 77858-21-0.
What is the molecular formula of 5-(2-甲酰基-3-羟基苯氧基)戊酸?
The molecular formula of 5-(2-甲酰基-3-羟基苯氧基)戊酸 is C12H14O5.
What is the molecular weight of 5-(2-甲酰基-3-羟基苯氧基)戊酸?
The molecular weight of 5-(2-甲酰基-3-羟基苯氧基)戊酸 is 238.08 g/mol.
Where can I buy 5-(2-甲酰基-3-羟基苯氧基)戊酸?
You can request a quote for 5-(2-甲酰基-3-羟基苯氧基)戊酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-甲酰基-3-羟基苯氧基)戊酸?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-甲酰基-3-羟基苯氧基)戊酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.