Amyl Angelate
TL;DR: Amyl Angelate (CAS 7785-63-9) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl 2-methylbut-2-enoate
Also Known As: Amyl tiglate, Amyl Angelate, Pentyl 2-methylisocrotonate, Pentyl 2-methyl-2-butenoate, AI3-33334
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 7785-63-9 |
|---|---|
| SMILES | CCCCCOC(=O)C(=CC)C |
| InChIKey | XJWDRSSGOHXOLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Amyl Angelate (CAS 7785-63-9), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: pentyl 2-methylbut-2-enoate.
Chemical Property Profile of Amyl Angelate
Property Insights of Amyl Angelate
The XLogP value of 3.1 indicates that Amyl Angelate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Amyl Angelate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Amyl Angelate 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 Amyl Angelate?
The CAS number of Amyl Angelate is 7785-63-9.
What is the molecular formula of Amyl Angelate?
The molecular formula of Amyl Angelate is C10H18O2.
What is the molecular weight of Amyl Angelate?
The molecular weight of Amyl Angelate is 170.13 g/mol.
Where can I buy Amyl Angelate?
You can request a quote for Amyl Angelate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Amyl Angelate?
Yes, KEHONG BIO provides custom synthesis services for Amyl Angelate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.