1-(1-Methylethyl)naphthalene
TL;DR: 1-(1-Methylethyl)naphthalene (CAS 6158-45-8) is a chemical compound with molecular formula C13H14 and molecular weight 170.10954 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-propan-2-ylnaphthalene
Also Known As: 1-ISOPROPYLNAPHTHALENE, 1-propan-2-ylnaphthalene, ISOPROPYLNAPHTHALENE, Naphthalene, 1-isopropyl-, Naphthalene, 1-(1-methylethyl)-
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H14 |
| Molecular Weight | 170.10954 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 170.10954 Da |
| Heavy Atoms | 13 |
| Complexity | 159.0 |
| SMILES | CC(C)C1=CC=CC2=CC=CC=C21 |
| InChIKey | PMPBFICDXLLSRM-UHFFFAOYSA-N |
Chemical Property Profile of 1-(1-Methylethyl)naphthalene
Property Insights of 1-(1-Methylethyl)naphthalene
The XLogP value of 4.6 indicates that 1-(1-Methylethyl)naphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-(1-Methylethyl)naphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Methylethyl)naphthalene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(1-Methylethyl)naphthalene?
The CAS number of 1-(1-Methylethyl)naphthalene is 6158-45-8.
What is the molecular formula of 1-(1-Methylethyl)naphthalene?
The molecular formula of 1-(1-Methylethyl)naphthalene is C13H14.
What is the molecular weight of 1-(1-Methylethyl)naphthalene?
The molecular weight of 1-(1-Methylethyl)naphthalene is 170.10954 g/mol.
Where can I buy 1-(1-Methylethyl)naphthalene?
You can request a quote for 1-(1-Methylethyl)naphthalene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(1-Methylethyl)naphthalene?
Yes, CoreyChem provides custom synthesis services for 1-(1-Methylethyl)naphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.