Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate
TL;DR: Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate (CAS 13562-03-3) is a chemical compound with molecular formula C13H8Cl3NO3 and molecular weight 330.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalen-1-yl N-(2,2,2-trichloroacetyl)carbamate
Also Known As: Naphthalen-1-yl (trichloroacetyl)carbamate, naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate, naphthalen-1-yl N-(2,2,2-trichloroacetyl)carbamate, F3110-1709, Trichloressigsaeure-naphthyl-(1)-oxycarbonylamid
| Molecular Formula | C13H8Cl3NO3 |
|---|---|
| Molecular Weight | 330.96 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 330.95697 |
| Heavy Atoms | 20 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 13562-03-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2OC(=O)NC(=O)C(Cl)(Cl)Cl |
| InChIKey | XOQVMLWEVJIYNT-UHFFFAOYSA-N |
Product Overview
Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate (CAS 13562-03-3), with molecular formula C13H8Cl3NO3 and molecular weight 330.96 g/mol. IUPAC: naphthalen-1-yl N-(2,2,2-trichloroacetyl)carbamate.
Chemical Property Profile of Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate
Property Insights of Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate
The XLogP value of 4.0 indicates that Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate has 1 hydrogen bond donor(s) and 3 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 Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate?
The CAS number of Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate is 13562-03-3.
What is the molecular formula of Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate?
The molecular formula of Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate is C13H8Cl3NO3.
What is the molecular weight of Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate?
The molecular weight of Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate is 330.96 g/mol.
Where can I buy Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate?
You can request a quote for Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Naphthalen-1-yl (2,2,2-trichloroacetyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.