Ethenyl propanoate--chloroethene (1/1)
TL;DR: Ethenyl propanoate--chloroethene (1/1) (CAS 31230-94-1) is a chemical compound with molecular formula C7H11ClO2 and molecular weight 162.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
chloroethene;ethenyl propanoate
Also Known As: chloroethene; ethenyl propanoate, Vinyl propionate, vinyl chloride polymer, ethenyl propanoate- chloroethene(1:1), (C5-H8-O2.C2-H3-Cl)x-, Ethenyl propanoate--chloroethene (1/1)
| Molecular Formula | C7H11ClO2 |
|---|---|
| Molecular Weight | 162.04 g/mol |
| LogP | 2.4518 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 162.04475 |
| Heavy Atoms | 10 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 31230-94-1 |
|---|---|
| SMILES | CCC(=O)OC=C.C=CCl |
| InChIKey | BCBHWVAFKCCWBG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethenyl propanoate--chloroethene (1/1) (CAS 31230-94-1), with molecular formula C7H11ClO2 and molecular weight 162.04 g/mol. IUPAC: chloroethene;ethenyl propanoate.
Chemical Property Profile of Ethenyl propanoate--chloroethene (1/1)
Property Insights of Ethenyl propanoate--chloroethene (1/1)
The XLogP value of 2.4518 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethenyl propanoate--chloroethene (1/1). With a topological polar surface area (TPSA) of 26.3 Ų, Ethenyl propanoate--chloroethene (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethenyl propanoate--chloroethene (1/1) 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 Ethenyl propanoate--chloroethene (1/1)?
The CAS number of Ethenyl propanoate--chloroethene (1/1) is 31230-94-1.
What is the molecular formula of Ethenyl propanoate--chloroethene (1/1)?
The molecular formula of Ethenyl propanoate--chloroethene (1/1) is C7H11ClO2.
What is the molecular weight of Ethenyl propanoate--chloroethene (1/1)?
The molecular weight of Ethenyl propanoate--chloroethene (1/1) is 162.04 g/mol.
Where can I buy Ethenyl propanoate--chloroethene (1/1)?
You can request a quote for Ethenyl propanoate--chloroethene (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethenyl propanoate--chloroethene (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Ethenyl propanoate--chloroethene (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.