Oxacyclododec-9-en-2-one, 12-methyl-, (9E)-
TL;DR: Oxacyclododec-9-en-2-one, 12-methyl-, (9E)- (CAS 58654-20-9) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-methyl-1-oxacyclododec-9-en-2-one
Also Known As: 12-methyl-1-oxacyclododec-9-en-2-one, Oxacyclododec-9-en-2-one, 12-methyl-, (9E)-, Oxacyclododec-9-en-2-one,12-methyl-,(9E)
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 58654-20-9 |
|---|---|
| SMILES | CC1CC=CCCCCCCC(=O)O1 |
| InChIKey | IYNKPPZNZQQWKC-UHFFFAOYSA-N |
Product Overview
Oxacyclododec-9-en-2-one, 12-methyl-, (9E)- (CAS 58654-20-9), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: 12-methyl-1-oxacyclododec-9-en-2-one.
Chemical Property Profile of Oxacyclododec-9-en-2-one, 12-methyl-, (9E)-
Property Insights of Oxacyclododec-9-en-2-one, 12-methyl-, (9E)-
The XLogP value of 3.6 indicates that Oxacyclododec-9-en-2-one, 12-methyl-, (9E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Oxacyclododec-9-en-2-one, 12-methyl-, (9E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxacyclododec-9-en-2-one, 12-methyl-, (9E)- 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 Oxacyclododec-9-en-2-one, 12-methyl-, (9E)-?
The CAS number of Oxacyclododec-9-en-2-one, 12-methyl-, (9E)- is 58654-20-9.
What is the molecular formula of Oxacyclododec-9-en-2-one, 12-methyl-, (9E)-?
The molecular formula of Oxacyclododec-9-en-2-one, 12-methyl-, (9E)- is C12H20O2.
What is the molecular weight of Oxacyclododec-9-en-2-one, 12-methyl-, (9E)-?
The molecular weight of Oxacyclododec-9-en-2-one, 12-methyl-, (9E)- is 196.15 g/mol.
Where can I buy Oxacyclododec-9-en-2-one, 12-methyl-, (9E)-?
You can request a quote for Oxacyclododec-9-en-2-one, 12-methyl-, (9E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxacyclododec-9-en-2-one, 12-methyl-, (9E)-?
Yes, KEHONG BIO provides custom synthesis services for Oxacyclododec-9-en-2-one, 12-methyl-, (9E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.