二氯乙炔
TL;DR: 二氯乙炔 (CAS 7572-29-4) is a chemical compound with molecular formula C2Cl2 and molecular weight 93.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二氯乙炔
1,2-dichloroethyne
Also Known As: DICHLOROACETYLENE, Dichloroethyne, 1,2-dichloroethyne, Ethyne, dichloro-, Acetylene, dichloro-
| Molecular Formula | C2Cl2 |
|---|---|
| Molecular Weight | 93.94 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 93.937706 |
| Heavy Atoms | 4 |
| Complexity | 46.0 |
| Melting Point | -87 to -50.0 °C |
| Boiling Point | 32.2 °C at 760 mmHg (Explodes) |
| Density | 1.26 |
| Solubility | Insoluble in water; soluble in ethanol, diethyl ether and acetone |
| Vapor Pressure | 570.0 [mmHg] |
Chemical Identifiers
| CAS Number | 7572-29-4 |
|---|---|
| SMILES | C(#CCl)Cl |
| InChIKey | ZMJOVJSTYLQINE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二氯乙炔 (CAS 7572-29-4), with molecular formula C2Cl2 and molecular weight 93.94 g/mol. IUPAC: 1,2-dichloroethyne.
Chemical Property Profile of 二氯乙炔
Property Insights of 二氯乙炔
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二氯乙炔. With a topological polar surface area (TPSA) of 0.0 Ų, 二氯乙炔 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二氯乙炔 has 0 hydrogen bond donor(s) and 0 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 二氯乙炔?
The CAS number of 二氯乙炔 is 7572-29-4.
What is the molecular formula of 二氯乙炔?
The molecular formula of 二氯乙炔 is C2Cl2.
What is the molecular weight of 二氯乙炔?
The molecular weight of 二氯乙炔 is 93.94 g/mol.
Where can I buy 二氯乙炔?
You can request a quote for 二氯乙炔 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二氯乙炔?
Yes, KEHONG BIO provides custom synthesis services for 二氯乙炔 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.