N-(prop-2-ynyloxy)phthalimide
TL;DR: N-(prop-2-ynyloxy)phthalimide (CAS 4616-63-1) is a chemical compound with molecular formula C11H7NO3 and molecular weight 201.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-prop-2-ynoxyisoindole-1,3-dione
Also Known As: N-(Propargyloxy)phthalimide, 2-(Prop-2-yn-1-yloxy)isoindoline-1,3-dione, n-propargyloxyphthalimide, Propargyl propionate, N-(Prop-2-ynyloxy)phthalimide
| Molecular Formula | C11H7NO3 |
|---|---|
| Molecular Weight | 201.04 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.04259 |
| Heavy Atoms | 15 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 4616-63-1 |
|---|---|
| SMILES | C#CCON1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | HBGZBVPXPDNXOV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(prop-2-ynyloxy)phthalimide (CAS 4616-63-1), with molecular formula C11H7NO3 and molecular weight 201.04 g/mol. IUPAC: 2-prop-2-ynoxyisoindole-1,3-dione.
Chemical Property Profile of N-(prop-2-ynyloxy)phthalimide
Property Insights of N-(prop-2-ynyloxy)phthalimide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(prop-2-ynyloxy)phthalimide. With a topological polar surface area (TPSA) of 46.6 Ų, N-(prop-2-ynyloxy)phthalimide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(prop-2-ynyloxy)phthalimide has 0 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 N-(prop-2-ynyloxy)phthalimide?
The CAS number of N-(prop-2-ynyloxy)phthalimide is 4616-63-1.
What is the molecular formula of N-(prop-2-ynyloxy)phthalimide?
The molecular formula of N-(prop-2-ynyloxy)phthalimide is C11H7NO3.
What is the molecular weight of N-(prop-2-ynyloxy)phthalimide?
The molecular weight of N-(prop-2-ynyloxy)phthalimide is 201.04 g/mol.
Where can I buy N-(prop-2-ynyloxy)phthalimide?
You can request a quote for N-(prop-2-ynyloxy)phthalimide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(prop-2-ynyloxy)phthalimide?
Yes, KEHONG BIO provides custom synthesis services for N-(prop-2-ynyloxy)phthalimide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.