2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)-
TL;DR: 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)- (CAS 91040-95-8) is a chemical compound with molecular formula C16H16O3 and molecular weight 256.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(2-methylpropanoyl)naphthalen-2-yl]acetic acid
Also Known As: 6-Isobutyryl-2-naphthaleneacetic acid, Acide isobutyryl-6 naphthyl-2 acetique, 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)-, Acide isobutyryl-6 naphthyl-2 acetique [French], [6-(2-Methylpropanoyl)naphthalen-2-yl]acetic acid
| Molecular Formula | C16H16O3 |
|---|---|
| Molecular Weight | 256.11 g/mol |
| LogP | 3.3056 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 256.10995 |
| Heavy Atoms | 19 |
| Complexity | 641.48413 |
Chemical Identifiers
| CAS Number | 91040-95-8 |
|---|---|
| SMILES | CC(C)C(=O)C1=CC2=C(C=C1)C=C(C=C2)CC(=O)O |
Product Overview
2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)- (CAS 91040-95-8), with molecular formula C16H16O3 and molecular weight 256.11 g/mol. IUPAC: 2-[6-(2-methylpropanoyl)naphthalen-2-yl]acetic acid.
Chemical Property Profile of 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)-
Property Insights of 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)-
The XLogP value of 3.3056 indicates that 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.37 Ų, 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)- has 1 hydrogen bond donor(s) and 2 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-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)-?
The CAS number of 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)- is 91040-95-8.
What is the molecular formula of 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)-?
The molecular formula of 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)- is C16H16O3.
What is the molecular weight of 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)-?
The molecular weight of 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)- is 256.11 g/mol.
Where can I buy 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)-?
You can request a quote for 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Naphthaleneacetic acid, 6-(2-methyl-1-oxopropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.