2-Ethylpent-4-enoyl chloride
TL;DR: 2-Ethylpent-4-enoyl chloride (CAS 85622-00-0) is a chemical compound with molecular formula C7H11ClO and molecular weight 146.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylpent-4-enoyl chloride
Also Known As: 2-ethylpent-4-enoyl chloride, 2-Ethylpent-4-enoylchloride, 2-Ethyl-4-pentenoyl chloride, 4-Pentenoyl chloride, 2-ethyl-
| Molecular Formula | C7H11ClO |
|---|---|
| Molecular Weight | 146.05 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 146.04984 |
| Heavy Atoms | 9 |
| Complexity | 109.0 |
Chemical Identifiers
| CAS Number | 85622-00-0 |
|---|---|
| SMILES | CCC(CC=C)C(=O)Cl |
| InChIKey | OBOAVSGVVHBVIN-UHFFFAOYSA-N |
Product Overview
2-Ethylpent-4-enoyl chloride (CAS 85622-00-0), with molecular formula C7H11ClO and molecular weight 146.05 g/mol. IUPAC: 2-ethylpent-4-enoyl chloride.
Chemical Property Profile of 2-Ethylpent-4-enoyl chloride
Property Insights of 2-Ethylpent-4-enoyl chloride
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethylpent-4-enoyl chloride. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Ethylpent-4-enoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethylpent-4-enoyl chloride 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 2-Ethylpent-4-enoyl chloride?
The CAS number of 2-Ethylpent-4-enoyl chloride is 85622-00-0.
What is the molecular formula of 2-Ethylpent-4-enoyl chloride?
The molecular formula of 2-Ethylpent-4-enoyl chloride is C7H11ClO.
What is the molecular weight of 2-Ethylpent-4-enoyl chloride?
The molecular weight of 2-Ethylpent-4-enoyl chloride is 146.05 g/mol.
Where can I buy 2-Ethylpent-4-enoyl chloride?
You can request a quote for 2-Ethylpent-4-enoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylpent-4-enoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylpent-4-enoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.