1-氯萘
TL;DR: 1-氯萘 (CAS 90-13-1) is a chemical compound with molecular formula C10H7Cl and molecular weight 162.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-氯萘
1-chloronaphthalene
Also Known As: 1-CHLORONAPHTHALENE, Chloronaphthalene, 1-Naphthyl chloride, alpha-Chloronaphthalene, xilamon
| Molecular Formula | C10H7Cl |
|---|---|
| Molecular Weight | 162.02 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 162.02362 |
| Heavy Atoms | 11 |
| Complexity | 133.0 |
| Melting Point | -9 to -20.0 °C |
| Boiling Point | 262.8 °C at 760 mmHg |
| Density | 1.1938 at 20.0 °C |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
| Flash Point | 121.1 °C |
| Vapor Pressure | 1 mmHg at 80.6 °C ; 100 mmHg at 180.4 °C; 760 mmHg at 259.3 °C |
| Refractive Index | 1.63321 @ 20 °C |
Chemical Identifiers
| CAS Number | 90-13-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2Cl |
| InChIKey | JTPNRXUCIXHOKM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-氯萘 (CAS 90-13-1), with molecular formula C10H7Cl and molecular weight 162.02 g/mol. IUPAC: 1-chloronaphthalene.
Chemical Property Profile of 1-氯萘
Property Insights of 1-氯萘
The XLogP value of 4.2 indicates that 1-氯萘 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-氯萘 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-氯萘 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
Frequently Asked Questions
What is the CAS number of 1-氯萘?
The CAS number of 1-氯萘 is 90-13-1.
What is the molecular formula of 1-氯萘?
The molecular formula of 1-氯萘 is C10H7Cl.
What is the molecular weight of 1-氯萘?
The molecular weight of 1-氯萘 is 162.02 g/mol.
Where can I buy 1-氯萘?
You can request a quote for 1-氯萘 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-氯萘?
Yes, KEHONG BIO provides custom synthesis services for 1-氯萘 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.