N-烯丙基苯胺
TL;DR: N-烯丙基苯胺 (CAS 589-09-3) is a chemical compound with molecular formula C9H11N and molecular weight 133.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-烯丙基苯胺
N-prop-2-enylaniline
Also Known As: N-Allylaniline, allylphenylamine, N-ALLYL-ANILINE, N-prop-2-enylaniline, Benzenamine, N-2-propenyl-
| Molecular Formula | C9H11N |
|---|---|
| Molecular Weight | 133.09 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 133.08914 |
| Heavy Atoms | 10 |
| Complexity | 92.0 |
Chemical Identifiers
| CAS Number | 589-09-3 |
|---|---|
| SMILES | C=CCNC1=CC=CC=C1 |
| InChIKey | LQFLWKPCQITJIH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-烯丙基苯胺 (CAS 589-09-3), with molecular formula C9H11N and molecular weight 133.09 g/mol. IUPAC: N-prop-2-enylaniline.
Chemical Property Profile of N-烯丙基苯胺
Property Insights of N-烯丙基苯胺
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-烯丙基苯胺. With a topological polar surface area (TPSA) of 12.0 Ų, N-烯丙基苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-烯丙基苯胺 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-烯丙基苯胺?
The CAS number of N-烯丙基苯胺 is 589-09-3.
What is the molecular formula of N-烯丙基苯胺?
The molecular formula of N-烯丙基苯胺 is C9H11N.
What is the molecular weight of N-烯丙基苯胺?
The molecular weight of N-烯丙基苯胺 is 133.09 g/mol.
Where can I buy N-烯丙基苯胺?
You can request a quote for N-烯丙基苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-烯丙基苯胺?
Yes, KEHONG BIO provides custom synthesis services for N-烯丙基苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.