N-methyl-N-prop-2-enoxyaniline
TL;DR: N-methyl-N-prop-2-enoxyaniline (CAS 77102-32-0) is a chemical compound with molecular formula C10H13NO and molecular weight 163.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-prop-2-enoxyaniline
Also Known As: N-methyl-N-prop-2-enoxyaniline, [(allyloxy)(methyl)amino]benzene, N-Methyl-N-[(prop-2-en-1-yl)oxy]aniline, Benzenamine,n-methyl-n-(2-propen-1-yloxy)-
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 77102-32-0 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)OCC=C |
| InChIKey | FYEZCGHRDYHDQI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-methyl-N-prop-2-enoxyaniline (CAS 77102-32-0), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: N-methyl-N-prop-2-enoxyaniline.
Chemical Property Profile of N-methyl-N-prop-2-enoxyaniline
Property Insights of N-methyl-N-prop-2-enoxyaniline
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-N-prop-2-enoxyaniline. With a topological polar surface area (TPSA) of 12.5 Ų, N-methyl-N-prop-2-enoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methyl-N-prop-2-enoxyaniline has 0 hydrogen bond donor(s) and 2 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-methyl-N-prop-2-enoxyaniline?
The CAS number of N-methyl-N-prop-2-enoxyaniline is 77102-32-0.
What is the molecular formula of N-methyl-N-prop-2-enoxyaniline?
The molecular formula of N-methyl-N-prop-2-enoxyaniline is C10H13NO.
What is the molecular weight of N-methyl-N-prop-2-enoxyaniline?
The molecular weight of N-methyl-N-prop-2-enoxyaniline is 163.10 g/mol.
Where can I buy N-methyl-N-prop-2-enoxyaniline?
You can request a quote for N-methyl-N-prop-2-enoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-N-prop-2-enoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-N-prop-2-enoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.