Cambridge id 5936386
TL;DR: Cambridge id 5936386 (CAS 109878-47-9) is a chemical compound with molecular formula C16H21NO and molecular weight 243.16231 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-benzyl-2,2-dimethyloxan-4-yl)acetonitrile
Also Known As: BAS 01312598, (4-Benzyl-2,2-dimethyloxan-4-yl)acetonitrile, 2-(4-benzyl-2,2-dimethyloxan-4-yl)acetonitrile, AB00101468-01, (4-benzyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)acetonitrile
Technical Specifications
| Molecular Formula | C16H21NO |
| Molecular Weight | 243.16231 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 33.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.16231 Da |
| Heavy Atoms | 18 |
| Complexity | 321.0 |
| SMILES | CC1(CC(CCO1)(CC#N)CC2=CC=CC=C2)C |
| InChIKey | WYWKEYZLXBPMSU-UHFFFAOYSA-N |
Chemical Property Profile of Cambridge id 5936386
Property Insights of Cambridge id 5936386
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cambridge id 5936386. With a topological polar surface area (TPSA) of 33.0 Ų, Cambridge id 5936386 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cambridge id 5936386 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
What is the CAS number of Cambridge id 5936386?
The CAS number of Cambridge id 5936386 is 109878-47-9.
What is the molecular formula of Cambridge id 5936386?
The molecular formula of Cambridge id 5936386 is C16H21NO.
What is the molecular weight of Cambridge id 5936386?
The molecular weight of Cambridge id 5936386 is 243.16231 g/mol.
Where can I buy Cambridge id 5936386?
You can request a quote for Cambridge id 5936386 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cambridge id 5936386?
Yes, CoreyChem provides custom synthesis services for Cambridge id 5936386 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.