Oxacycloheptadec-7-en-2-one
TL;DR: Oxacycloheptadec-7-en-2-one (CAS 223104-10-7) is a chemical compound with molecular formula C16H28O2 and molecular weight 252.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7E)-1-oxacycloheptadec-7-en-2-one
Also Known As: D6-Ambrettolide, Ambrettolide, 6-Hexadecenolide, Oxacycloheptadec-7-en-2-one, delta6-Isoambrettolide
| Molecular Formula | C16H28O2 |
|---|---|
| Molecular Weight | 252.21 g/mol |
| LogP | 4.7806 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 252.20892 |
| Heavy Atoms | 18 |
| Complexity | 233.25146 |
Chemical Identifiers
| CAS Number | 223104-10-7 |
|---|---|
| SMILES | C1CCCC/C=C/CCCCC(=O)OCCCC1 |
Product Overview
Oxacycloheptadec-7-en-2-one (CAS 223104-10-7), with molecular formula C16H28O2 and molecular weight 252.21 g/mol. IUPAC: (7E)-1-oxacycloheptadec-7-en-2-one.
Chemical Property Profile of Oxacycloheptadec-7-en-2-one
Property Insights of Oxacycloheptadec-7-en-2-one
The XLogP value of 4.7806 indicates that Oxacycloheptadec-7-en-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Oxacycloheptadec-7-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxacycloheptadec-7-en-2-one 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 Oxacycloheptadec-7-en-2-one?
The CAS number of Oxacycloheptadec-7-en-2-one is 223104-10-7.
What is the molecular formula of Oxacycloheptadec-7-en-2-one?
The molecular formula of Oxacycloheptadec-7-en-2-one is C16H28O2.
What is the molecular weight of Oxacycloheptadec-7-en-2-one?
The molecular weight of Oxacycloheptadec-7-en-2-one is 252.21 g/mol.
Where can I buy Oxacycloheptadec-7-en-2-one?
You can request a quote for Oxacycloheptadec-7-en-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxacycloheptadec-7-en-2-one?
Yes, KEHONG BIO provides custom synthesis services for Oxacycloheptadec-7-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.