7-(Bromomethyl)-2-naphthonitrile
TL;DR: 7-(Bromomethyl)-2-naphthonitrile (CAS 135942-98-2) is a chemical compound with molecular formula C12H8BrN and molecular weight 244.98401 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-(bromomethyl)naphthalene-2-carbonitrile
Also Known As: 7-(Bromomethyl)-2-naphthonitrile, 7-(bromomethyl)naphthalene-2-carbonitrile, 2-Naphthalenecarbonitrile, 7-(bromomethyl)-, 7-bromomethyl-2-naphthonitrile, 7-Bromomethyl-2-naphthalenecarbonitrile
Technical Specifications
| Molecular Formula | C12H8BrN |
| Molecular Weight | 244.98401 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.98401 Da |
| Heavy Atoms | 14 |
| Complexity | 242.0 |
| SMILES | C1=CC(=CC2=C1C=CC(=C2)C#N)CBr |
| InChIKey | VMWIZZARXXSROL-UHFFFAOYSA-N |
Chemical Property Profile of 7-(Bromomethyl)-2-naphthonitrile
Property Insights of 7-(Bromomethyl)-2-naphthonitrile
The XLogP value of 3.4 indicates that 7-(Bromomethyl)-2-naphthonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, 7-(Bromomethyl)-2-naphthonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-(Bromomethyl)-2-naphthonitrile has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 7-(Bromomethyl)-2-naphthonitrile?
The CAS number of 7-(Bromomethyl)-2-naphthonitrile is 135942-98-2.
What is the molecular formula of 7-(Bromomethyl)-2-naphthonitrile?
The molecular formula of 7-(Bromomethyl)-2-naphthonitrile is C12H8BrN.
What is the molecular weight of 7-(Bromomethyl)-2-naphthonitrile?
The molecular weight of 7-(Bromomethyl)-2-naphthonitrile is 244.98401 g/mol.
Where can I buy 7-(Bromomethyl)-2-naphthonitrile?
You can request a quote for 7-(Bromomethyl)-2-naphthonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7-(Bromomethyl)-2-naphthonitrile?
Yes, CoreyChem provides custom synthesis services for 7-(Bromomethyl)-2-naphthonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.