4-Methyl-1-naphthalenecarboxylic acid
TL;DR: 4-Methyl-1-naphthalenecarboxylic acid (CAS 4488-40-8) is a chemical compound with molecular formula C12H10O2 and molecular weight 186.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylnaphthalene-1-carboxylic acid
Also Known As: 4-Methyl-1-naphthoic acid, null, 4-methylnaphthalene-1-carboxylic acid, 4-Methyl-1-napthoic acid, 4-Methyl-1-naphthalenecarboxylic acid
| Molecular Formula | C12H10O2 |
|---|---|
| Molecular Weight | 186.07 g/mol |
| LogP | 2.84642 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 186.06808 |
| Heavy Atoms | 14 |
| Complexity | 500.64792 |
Chemical Identifiers
| CAS Number | 4488-40-8 |
|---|---|
| SMILES | CC1=CC=C(C2=CC=CC=C12)C(=O)O |
Product Overview
4-Methyl-1-naphthalenecarboxylic acid (CAS 4488-40-8), with molecular formula C12H10O2 and molecular weight 186.07 g/mol. IUPAC: 4-methylnaphthalene-1-carboxylic acid.
Chemical Property Profile of 4-Methyl-1-naphthalenecarboxylic acid
Property Insights of 4-Methyl-1-naphthalenecarboxylic acid
The XLogP value of 2.84642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-1-naphthalenecarboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 4-Methyl-1-naphthalenecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-1-naphthalenecarboxylic acid has 1 hydrogen bond donor(s) and 1 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 4-Methyl-1-naphthalenecarboxylic acid?
The CAS number of 4-Methyl-1-naphthalenecarboxylic acid is 4488-40-8.
What is the molecular formula of 4-Methyl-1-naphthalenecarboxylic acid?
The molecular formula of 4-Methyl-1-naphthalenecarboxylic acid is C12H10O2.
What is the molecular weight of 4-Methyl-1-naphthalenecarboxylic acid?
The molecular weight of 4-Methyl-1-naphthalenecarboxylic acid is 186.07 g/mol.
Where can I buy 4-Methyl-1-naphthalenecarboxylic acid?
You can request a quote for 4-Methyl-1-naphthalenecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-1-naphthalenecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-1-naphthalenecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.