N-(6-Chloro-6-oxohexyl)phthalimide
TL;DR: N-(6-Chloro-6-oxohexyl)phthalimide (CAS 31968-60-2) is a chemical compound with molecular formula C14H14ClNO3 and molecular weight 279.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1,3-dioxoisoindol-2-yl)hexanoyl chloride
Also Known As: 6-phthalimidohexanoyl chloride, N-(6-Chloro-6-oxohexyl)phthalimide, ZERO/001700, 6-(1,3-dioxoisoindol-2-yl)hexanoyl chloride, 6-(Phthalimid-1-yl)hexanoyl chloride
| Molecular Formula | C14H14ClNO3 |
|---|---|
| Molecular Weight | 279.07 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 279.06622 |
| Heavy Atoms | 19 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 31968-60-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCC(=O)Cl |
| InChIKey | KOQCISGPATVUJH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(6-Chloro-6-oxohexyl)phthalimide (CAS 31968-60-2), with molecular formula C14H14ClNO3 and molecular weight 279.07 g/mol. IUPAC: 6-(1,3-dioxoisoindol-2-yl)hexanoyl chloride.
Chemical Property Profile of N-(6-Chloro-6-oxohexyl)phthalimide
Property Insights of N-(6-Chloro-6-oxohexyl)phthalimide
The XLogP value of 3.0 indicates that N-(6-Chloro-6-oxohexyl)phthalimide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.5 Ų, N-(6-Chloro-6-oxohexyl)phthalimide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(6-Chloro-6-oxohexyl)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-(6-Chloro-6-oxohexyl)phthalimide?
The CAS number of N-(6-Chloro-6-oxohexyl)phthalimide is 31968-60-2.
What is the molecular formula of N-(6-Chloro-6-oxohexyl)phthalimide?
The molecular formula of N-(6-Chloro-6-oxohexyl)phthalimide is C14H14ClNO3.
What is the molecular weight of N-(6-Chloro-6-oxohexyl)phthalimide?
The molecular weight of N-(6-Chloro-6-oxohexyl)phthalimide is 279.07 g/mol.
Where can I buy N-(6-Chloro-6-oxohexyl)phthalimide?
You can request a quote for N-(6-Chloro-6-oxohexyl)phthalimide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6-Chloro-6-oxohexyl)phthalimide?
Yes, KEHONG BIO provides custom synthesis services for N-(6-Chloro-6-oxohexyl)phthalimide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.