1-Propene, 1,2-dichloro-
TL;DR: 1-Propene, 1,2-dichloro- (CAS 563-54-2) is a chemical compound with molecular formula C3H4Cl2 and molecular weight 109.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dichloroprop-1-ene
Also Known As: Dichlor, 1,2-dichloroprop-1-ene, 1-Propene, 1,2-dichloro-, 1,2-Dichloropropylene, Dichlorpropen-gemisch
| Molecular Formula | C3H4Cl2 |
|---|---|
| Molecular Weight | 109.97 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 109.969 |
| Heavy Atoms | 5 |
| Complexity | 46.0 |
| Boiling Point | 75 °C |
| Density | 1.1818 @ 20°C |
| Solubility | In water, 2,700 mg/l @ 25 °C. |
| Vapor Pressure | 90.8 [mmHg] |
Chemical Identifiers
| CAS Number | 563-54-2 |
|---|---|
| SMILES | CC(=CCl)Cl |
| InChIKey | PPKPKFIWDXDAGC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propene, 1,2-dichloro- (CAS 563-54-2), with molecular formula C3H4Cl2 and molecular weight 109.97 g/mol. IUPAC: 1,2-dichloroprop-1-ene.
Chemical Property Profile of 1-Propene, 1,2-dichloro-
Property Insights of 1-Propene, 1,2-dichloro-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propene, 1,2-dichloro-. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Propene, 1,2-dichloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propene, 1,2-dichloro- 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 1-Propene, 1,2-dichloro-?
The CAS number of 1-Propene, 1,2-dichloro- is 563-54-2.
What is the molecular formula of 1-Propene, 1,2-dichloro-?
The molecular formula of 1-Propene, 1,2-dichloro- is C3H4Cl2.
What is the molecular weight of 1-Propene, 1,2-dichloro-?
The molecular weight of 1-Propene, 1,2-dichloro- is 109.97 g/mol.
Where can I buy 1-Propene, 1,2-dichloro-?
You can request a quote for 1-Propene, 1,2-dichloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propene, 1,2-dichloro-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propene, 1,2-dichloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.