二氯乙酰氯
TL;DR: 二氯乙酰氯 (CAS 79-36-7) is a chemical compound with molecular formula C2HCl3O and molecular weight 145.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二氯乙酰氯
2,2-dichloroacetyl chloride
Also Known As: DICHLOROACETYL CHLORIDE, 2,2-Dichloroacetyl chloride, Dichloracetyl chloride, Dichloroethanoyl chloride, Acetyl chloride, dichloro-
| Molecular Formula | C2HCl3O |
|---|---|
| Molecular Weight | 145.91 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 145.9093 |
| Heavy Atoms | 6 |
| Complexity | 59.0 |
| Boiling Point | 225 to 107.8 °C at 760 mmHg |
| Density | 1.5315 at 16.1 °C |
| Solubility | Decomposes (NTP, 1992) |
| Flash Point | 66.1 °C |
| Vapor Pressure | 154 mmHg at 25.0 °C |
| Refractive Index | 1.4638 @ 16 °C |
Chemical Identifiers
| CAS Number | 79-36-7 |
|---|---|
| SMILES | C(C(=O)Cl)(Cl)Cl |
| InChIKey | FBCCMZVIWNDFMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二氯乙酰氯 (CAS 79-36-7), with molecular formula C2HCl3O and molecular weight 145.91 g/mol. IUPAC: 2,2-dichloroacetyl chloride.
Chemical Property Profile of 二氯乙酰氯
Property Insights of 二氯乙酰氯
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二氯乙酰氯. With a topological polar surface area (TPSA) of 17.1 Ų, 二氯乙酰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二氯乙酰氯 has 0 hydrogen bond donor(s) and 1 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 二氯乙酰氯?
The CAS number of 二氯乙酰氯 is 79-36-7.
What is the molecular formula of 二氯乙酰氯?
The molecular formula of 二氯乙酰氯 is C2HCl3O.
What is the molecular weight of 二氯乙酰氯?
The molecular weight of 二氯乙酰氯 is 145.91 g/mol.
Where can I buy 二氯乙酰氯?
You can request a quote for 二氯乙酰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二氯乙酰氯?
Yes, KEHONG BIO provides custom synthesis services for 二氯乙酰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.