Benzenamine,nitroso
TL;DR: Benzenamine,nitroso (CAS 113811-42-0) is a chemical compound with molecular formula C15H18O4 and molecular weight 262.1205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
13-(methoxymethyl)-10-methyl-2-oxatricyclo[7.3.1.05,13]trideca-6,10-diene-3,12-dione
Also Known As: Benzenamine,nitroso, 9b-(methoxymethyl)-7-methyl-3,3a,6,6a,9a,9b-hexahydrobenzo[de]chromene-2,9-dione, Naphtho(1,8-bc)pyran-2,7-dione, 3,3a,6,6a,9a,9b-hexahydro-9b-(methoxymethyl)-7-methyl-, (3aalpha,6abeta,9aalpha,9balpha)-, Naphtho(1,8-bc)pyran-2,9-dione, 3,3a,6,6a,9a,9b-hexahydro-9b-(methoxymethyl)-7-methyl-, (3aalpha,6abeta,9abeta,9balpha)-, 9b-(Methoxymethyl)-7-methyl-3,3a,6,6a,9a,9b-hexahydronaphtho[1,8-bc]pyran-2,9-dione
Technical Specifications
| Molecular Formula | C15H18O4 |
| Molecular Weight | 262.1205 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.1205 Da |
| Heavy Atoms | 19 |
| Complexity | 490.0 |
| SMILES | CC1=CC(=O)C2C3(C1CC=CC3CC(=O)O2)COC |
| InChIKey | NTHFPMAPVSAVSJ-UHFFFAOYSA-N |
Chemical Property Profile of Benzenamine,nitroso
Property Insights of Benzenamine,nitroso
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenamine,nitroso. With a topological polar surface area (TPSA) of 52.6 Ų, Benzenamine,nitroso exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine,nitroso has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzenamine,nitroso?
The CAS number of Benzenamine,nitroso is 113811-42-0.
What is the molecular formula of Benzenamine,nitroso?
The molecular formula of Benzenamine,nitroso is C15H18O4.
What is the molecular weight of Benzenamine,nitroso?
The molecular weight of Benzenamine,nitroso is 262.1205 g/mol.
Where can I buy Benzenamine,nitroso?
You can request a quote for Benzenamine,nitroso directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzenamine,nitroso?
Yes, CoreyChem provides custom synthesis services for Benzenamine,nitroso and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.