Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate
TL;DR: Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate (CAS 101657-02-7) is a chemical compound with molecular formula C25H28BrNO2 and molecular weight 453.13034 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(2,2-diphenylacetyl)oxy-1-phenylethyl]-trimethylazanium bromide
Also Known As: FC 645/A, (alpha-(Hydroxymethyl)benzyl)trimethylammonium bromide diphenylacetate, [2-(2,2-diphenylacetyl)oxy-1-phenylethyl]-trimethylazanium bromide, AMMONIUM, (alpha-(HYDROXYMETHYL)BENZYL)TRIMETHYL-, BROMIDE, DIPHENYLACETATE, (alpha-(Hydroxymethyl)benzyl)trimethylammonium bromide, diphenylacetate
Technical Specifications
| Molecular Formula | C25H28BrNO2 |
| Molecular Weight | 453.13034 g/mol |
| XLogP | 1.81 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 453.13034 Da |
| Heavy Atoms | 29 |
| Complexity | 447.0 |
| SMILES | C[N+](C)(C)C(COC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3.[Br-] |
| InChIKey | VBKBEUHDALYPGT-UHFFFAOYSA-M |
Chemical Property Profile of Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate
Property Insights of Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate
The XLogP value of 1.81 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate. With a topological polar surface area (TPSA) of 26.3 Ų, Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate?
The CAS number of Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate is 101657-02-7.
What is the molecular formula of Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate?
The molecular formula of Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate is C25H28BrNO2.
What is the molecular weight of Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate?
The molecular weight of Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate is 453.13034 g/mol.
Where can I buy Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate?
You can request a quote for Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate?
Yes, CoreyChem provides custom synthesis services for Ammonium, (alpha-(hydroxymethyl)benzyl)trimethyl-, bromide, diphenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.