2-Heptylnaphthalene
TL;DR: 2-Heptylnaphthalene (CAS 2876-45-1) is a chemical compound with molecular formula C17H22 and molecular weight 226.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-heptylnaphthalene
Also Known As: 2-heptylnaphthalene, 2-heptyl-naphthalene, Naphthalene, 2-heptyl-
| Molecular Formula | C17H22 |
|---|---|
| Molecular Weight | 226.17 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 226.17215 |
| Heavy Atoms | 17 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 2876-45-1 |
|---|---|
| SMILES | CCCCCCCC1=CC2=CC=CC=C2C=C1 |
| InChIKey | ISVPANZFACDCFN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Heptylnaphthalene (CAS 2876-45-1), with molecular formula C17H22 and molecular weight 226.17 g/mol. IUPAC: 2-heptylnaphthalene.
Chemical Property Profile of 2-Heptylnaphthalene
Property Insights of 2-Heptylnaphthalene
The XLogP value of 7.1 indicates that 2-Heptylnaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Heptylnaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Heptylnaphthalene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Heptylnaphthalene?
The CAS number of 2-Heptylnaphthalene is 2876-45-1.
What is the molecular formula of 2-Heptylnaphthalene?
The molecular formula of 2-Heptylnaphthalene is C17H22.
What is the molecular weight of 2-Heptylnaphthalene?
The molecular weight of 2-Heptylnaphthalene is 226.17 g/mol.
Where can I buy 2-Heptylnaphthalene?
You can request a quote for 2-Heptylnaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Heptylnaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 2-Heptylnaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.