N-乙基-1-萘胺
TL;DR: N-乙基-1-萘胺 (CAS 118-44-5) is a chemical compound with molecular formula C12H13N and molecular weight 171.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-乙基-1-萘胺
N-ethylnaphthalen-1-amine
Also Known As: N-Ethyl-1-naphthylamine, n-ethylnaphthalen-1-amine, 1-Naphthalenamine, N-ethyl-, N-ethyl-1-naphthalenamine, Ethyl(1-naphthyl)amine
| Molecular Formula | C12H13N |
|---|---|
| Molecular Weight | 171.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 171.1048 |
| Heavy Atoms | 13 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 118-44-5 |
|---|---|
| SMILES | CCNC1=CC=CC2=CC=CC=C21 |
| InChIKey | KDFFXYVOTKKBDI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-乙基-1-萘胺 (CAS 118-44-5), with molecular formula C12H13N and molecular weight 171.10 g/mol. IUPAC: N-ethylnaphthalen-1-amine.
Chemical Property Profile of N-乙基-1-萘胺
Property Insights of N-乙基-1-萘胺
The XLogP value of 3.2 indicates that N-乙基-1-萘胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, N-乙基-1-萘胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-乙基-1-萘胺 has 1 hydrogen bond donor(s) and 1 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 N-乙基-1-萘胺?
The CAS number of N-乙基-1-萘胺 is 118-44-5.
What is the molecular formula of N-乙基-1-萘胺?
The molecular formula of N-乙基-1-萘胺 is C12H13N.
What is the molecular weight of N-乙基-1-萘胺?
The molecular weight of N-乙基-1-萘胺 is 171.10 g/mol.
Where can I buy N-乙基-1-萘胺?
You can request a quote for N-乙基-1-萘胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-乙基-1-萘胺?
Yes, KEHONG BIO provides custom synthesis services for N-乙基-1-萘胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.