N-氯代邻苯二甲酰亚胺
TL;DR: N-氯代邻苯二甲酰亚胺 (CAS 3481-09-2) is a chemical compound with molecular formula C8H4ClNO2 and molecular weight 180.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-氯代邻苯二甲酰亚胺
2-chloroisoindole-1,3-dione
Also Known As: N-CHLOROPHTHALIMIDE, 2-Chloroisoindoline-1,3-dione, n-chlorphthalimid, 2-chloroisoindole-1,3-dione, Phthalimide chloride
| Molecular Formula | C8H4ClNO2 |
|---|---|
| Molecular Weight | 180.99 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 180.99306 |
| Heavy Atoms | 12 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 3481-09-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)Cl |
| InChIKey | WDRFYIPWHMGQPN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-氯代邻苯二甲酰亚胺 (CAS 3481-09-2), with molecular formula C8H4ClNO2 and molecular weight 180.99 g/mol. IUPAC: 2-chloroisoindole-1,3-dione.
Chemical Property Profile of N-氯代邻苯二甲酰亚胺
Property Insights of N-氯代邻苯二甲酰亚胺
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-氯代邻苯二甲酰亚胺. With a topological polar surface area (TPSA) of 37.4 Ų, N-氯代邻苯二甲酰亚胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-氯代邻苯二甲酰亚胺 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-氯代邻苯二甲酰亚胺?
The CAS number of N-氯代邻苯二甲酰亚胺 is 3481-09-2.
What is the molecular formula of N-氯代邻苯二甲酰亚胺?
The molecular formula of N-氯代邻苯二甲酰亚胺 is C8H4ClNO2.
What is the molecular weight of N-氯代邻苯二甲酰亚胺?
The molecular weight of N-氯代邻苯二甲酰亚胺 is 180.99 g/mol.
Where can I buy N-氯代邻苯二甲酰亚胺?
You can request a quote for N-氯代邻苯二甲酰亚胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-氯代邻苯二甲酰亚胺?
Yes, KEHONG BIO provides custom synthesis services for N-氯代邻苯二甲酰亚胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.