3,3'-(硝基亚氨基)双(丙酰氯)
TL;DR: 3,3'-(硝基亚氨基)双(丙酰氯) (CAS 15618-76-5) is a chemical compound with molecular formula C6H8Cl2N2O4 and molecular weight 241.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3'-(硝基亚氨基)双(丙酰氯)
3-[(3-chloro-3-oxopropyl)-nitroamino]propanoyl chloride
Also Known As: Propanoyl chloride, 3,3'-(nitroimino)bis-, 3,3'-(nitroimino)dipropanoyl chloride, Propionyl chloride, 3,3'-(nitroimino)di-, 3-[(3-chloro-3-oxopropyl)-nitroamino]propanoyl chloride, 3,3'-(Nitroazanediyl)dipropanoyl chloride
| Molecular Formula | C6H8Cl2N2O4 |
|---|---|
| Molecular Weight | 241.99 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 83.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 241.98611 |
| Heavy Atoms | 14 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 15618-76-5 |
|---|---|
| SMILES | C(CN(CCC(=O)Cl)[N+](=O)[O-])C(=O)Cl |
| InChIKey | QRYWNKCZHYEOKG-UHFFFAOYSA-N |
Product Overview
3,3'-(硝基亚氨基)双(丙酰氯) (CAS 15618-76-5), with molecular formula C6H8Cl2N2O4 and molecular weight 241.99 g/mol. IUPAC: 3-[(3-chloro-3-oxopropyl)-nitroamino]propanoyl chloride.
Chemical Property Profile of 3,3'-(硝基亚氨基)双(丙酰氯)
Property Insights of 3,3'-(硝基亚氨基)双(丙酰氯)
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3'-(硝基亚氨基)双(丙酰氯). The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-(硝基亚氨基)双(丙酰氯). Following Lipinski's Rule of Five, 3,3'-(硝基亚氨基)双(丙酰氯) has 0 hydrogen bond donor(s) and 5 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 3,3'-(硝基亚氨基)双(丙酰氯)?
The CAS number of 3,3'-(硝基亚氨基)双(丙酰氯) is 15618-76-5.
What is the molecular formula of 3,3'-(硝基亚氨基)双(丙酰氯)?
The molecular formula of 3,3'-(硝基亚氨基)双(丙酰氯) is C6H8Cl2N2O4.
What is the molecular weight of 3,3'-(硝基亚氨基)双(丙酰氯)?
The molecular weight of 3,3'-(硝基亚氨基)双(丙酰氯) is 241.99 g/mol.
Where can I buy 3,3'-(硝基亚氨基)双(丙酰氯)?
You can request a quote for 3,3'-(硝基亚氨基)双(丙酰氯) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-(硝基亚氨基)双(丙酰氯)?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-(硝基亚氨基)双(丙酰氯) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.