Naphthalene, 1-isocyano-
TL;DR: Naphthalene, 1-isocyano- (CAS 1984-04-9) is a chemical compound with molecular formula C11H7N and molecular weight 153.05785 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-isocyanonaphthalene
Also Known As: 1-ISOCYANONAPHTHALENE, Naphthalene, 1-isocyano-, alpha-Isocyanonaphthalene, 1-Naphthyl isocyanide, Naphthalene,1-isocyano-
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H7N |
| Molecular Weight | 153.05785 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 4.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 153.05785 Da |
| Heavy Atoms | 12 |
| Complexity | 200.0 |
| SMILES | [C-]#[N+]C1=CC=CC2=CC=CC=C21 |
| InChIKey | PTCSLGONLAYNQB-UHFFFAOYSA-N |
Chemical Property Profile of Naphthalene, 1-isocyano-
Property Insights of Naphthalene, 1-isocyano-
The XLogP value of 3.3 indicates that Naphthalene, 1-isocyano- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 4.4 Ų, Naphthalene, 1-isocyano- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphthalene, 1-isocyano- 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 Naphthalene, 1-isocyano-?
The CAS number of Naphthalene, 1-isocyano- is 1984-04-9.
What is the molecular formula of Naphthalene, 1-isocyano-?
The molecular formula of Naphthalene, 1-isocyano- is C11H7N.
What is the molecular weight of Naphthalene, 1-isocyano-?
The molecular weight of Naphthalene, 1-isocyano- is 153.05785 g/mol.
Where can I buy Naphthalene, 1-isocyano-?
You can request a quote for Naphthalene, 1-isocyano- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Naphthalene, 1-isocyano-?
Yes, CoreyChem provides custom synthesis services for Naphthalene, 1-isocyano- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.