(3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid
TL;DR: (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid (CAS 613-41-2) is a chemical compound with molecular formula C14H10O4 and molecular weight 242.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-(3-hydroxynaphthalen-2-yl)-2-oxobut-3-enoic acid
Also Known As: (Z)-4-(3-Hydroxynaphthalen-2-yl)-2-oxobut-3-enoic acid, cis-4-{2'-hydroxynaphth-3-yl)-2-oxobutenoic acid, (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid, (Z)-4-(3-hydroxynaphthalen-2-yl)-2-oxo-but-3-enoic Acid, (3Z)-4-(3-HYDROXYNAPHTHALEN-2-YL)-2-OXOBUT-3-ENOIC ACID
| Molecular Formula | C14H10O4 |
|---|---|
| Molecular Weight | 242.06 g/mol |
| LogP | 2.2123 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.0579 |
| Heavy Atoms | 18 |
| Complexity | 655.8916 |
Chemical Identifiers
| CAS Number | 613-41-2 |
|---|---|
| SMILES | C1=CC=C2C=C(C(=CC2=C1)/C=C\C(=O)C(=O)O)O |
Product Overview
(3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid (CAS 613-41-2), with molecular formula C14H10O4 and molecular weight 242.06 g/mol. IUPAC: (Z)-4-(3-hydroxynaphthalen-2-yl)-2-oxobut-3-enoic acid.
Chemical Property Profile of (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid
Property Insights of (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid
The XLogP value of 2.2123 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid. Following Lipinski's Rule of Five, (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid has 2 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 (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid?
The CAS number of (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid is 613-41-2.
What is the molecular formula of (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid?
The molecular formula of (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid is C14H10O4.
What is the molecular weight of (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid?
The molecular weight of (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid is 242.06 g/mol.
Where can I buy (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid?
You can request a quote for (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid?
Yes, KEHONG BIO provides custom synthesis services for (3Z)-4-(3-Hydroxy-2-naphthalenyl)-2-oxo-3-butenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.