维兰德-米舍尔酮
TL;DR: 维兰德-米舍尔酮 (CAS 20007-72-1) is a chemical compound with molecular formula C11H14O2 and molecular weight 178.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
维兰德-米舍尔酮
8a-methyl-3,4,7,8-tetrahydro-2H-naphthalene-1,6-dione
Also Known As: Wieland-Miescher ketone, MODX, Wieland-Michler ketone, Wieland-Miescher-Keton, Miescher-Wieland ketone
| Molecular Formula | C11H14O2 |
|---|---|
| Molecular Weight | 178.10 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.09938 |
| Heavy Atoms | 13 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 20007-72-1 |
|---|---|
| SMILES | CC12CCC(=O)C=C1CCCC2=O |
| InChIKey | DNHDRUMZDHWHKG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
维兰德-米舍尔酮 (CAS 20007-72-1), with molecular formula C11H14O2 and molecular weight 178.10 g/mol. IUPAC: 8a-methyl-3,4,7,8-tetrahydro-2H-naphthalene-1,6-dione.
Chemical Property Profile of 维兰德-米舍尔酮
Property Insights of 维兰德-米舍尔酮
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 维兰德-米舍尔酮. With a topological polar surface area (TPSA) of 34.1 Ų, 维兰德-米舍尔酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 维兰德-米舍尔酮 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 维兰德-米舍尔酮?
The CAS number of 维兰德-米舍尔酮 is 20007-72-1.
What is the molecular formula of 维兰德-米舍尔酮?
The molecular formula of 维兰德-米舍尔酮 is C11H14O2.
What is the molecular weight of 维兰德-米舍尔酮?
The molecular weight of 维兰德-米舍尔酮 is 178.10 g/mol.
Where can I buy 维兰德-米舍尔酮?
You can request a quote for 维兰德-米舍尔酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 维兰德-米舍尔酮?
Yes, KEHONG BIO provides custom synthesis services for 维兰德-米舍尔酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.