2-Naphthaleneacetic acid, 6-(2-methylpropyl)-
TL;DR: 2-Naphthaleneacetic acid, 6-(2-methylpropyl)- (CAS 91040-96-9) is a chemical compound with molecular formula C16H18O2 and molecular weight 242.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(2-methylpropyl)naphthalen-2-yl]acetic acid
Also Known As: 6-Isobutyl-2-naphthaleneacetic acid, Acide isobutyl-6 naphthyl-2 acetique, 2-Naphthaleneacetic acid, 6-(2-methylpropyl)-, 6-(2-Methylpropyl)-2-naphthaleneacetic acid, Acide isobutyl-6 naphthyl-2 acetique [French]
| Molecular Formula | C16H18O2 |
|---|---|
| Molecular Weight | 242.13 g/mol |
| LogP | 3.6654 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.13068 |
| Heavy Atoms | 18 |
| Complexity | 570.3187 |
Chemical Identifiers
| CAS Number | 91040-96-9 |
|---|---|
| SMILES | CC(C)CC1=CC2=C(C=C1)C=C(C=C2)CC(=O)O |
Product Overview
2-Naphthaleneacetic acid, 6-(2-methylpropyl)- (CAS 91040-96-9), with molecular formula C16H18O2 and molecular weight 242.13 g/mol. IUPAC: 2-[6-(2-methylpropyl)naphthalen-2-yl]acetic acid.
Chemical Property Profile of 2-Naphthaleneacetic acid, 6-(2-methylpropyl)-
Property Insights of 2-Naphthaleneacetic acid, 6-(2-methylpropyl)-
The XLogP value of 3.6654 indicates that 2-Naphthaleneacetic acid, 6-(2-methylpropyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Naphthaleneacetic acid, 6-(2-methylpropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Naphthaleneacetic acid, 6-(2-methylpropyl)- 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 2-Naphthaleneacetic acid, 6-(2-methylpropyl)-?
The CAS number of 2-Naphthaleneacetic acid, 6-(2-methylpropyl)- is 91040-96-9.
What is the molecular formula of 2-Naphthaleneacetic acid, 6-(2-methylpropyl)-?
The molecular formula of 2-Naphthaleneacetic acid, 6-(2-methylpropyl)- is C16H18O2.
What is the molecular weight of 2-Naphthaleneacetic acid, 6-(2-methylpropyl)-?
The molecular weight of 2-Naphthaleneacetic acid, 6-(2-methylpropyl)- is 242.13 g/mol.
Where can I buy 2-Naphthaleneacetic acid, 6-(2-methylpropyl)-?
You can request a quote for 2-Naphthaleneacetic acid, 6-(2-methylpropyl)- 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-methylpropyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Naphthaleneacetic acid, 6-(2-methylpropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.