4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline
TL;DR: 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline (CAS 405277-41-0) is a chemical compound with molecular formula C13H19NO2 and molecular weight 221.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)aniline
Also Known As: 4-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)aniline, [4-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)phenyl]amine, 4-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)phenylamine, 834-362-3, RefChem:513476
| Molecular Formula | C13H19NO2 |
|---|---|
| Molecular Weight | 221.14 g/mol |
| LogP | 2.8714 |
| Topological Polar Surface Area | 44.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 221.14159 |
| Heavy Atoms | 16 |
| Complexity | 365.424 |
Chemical Identifiers
| CAS Number | 405277-41-0 |
|---|---|
| SMILES | CC1(C(OC(O1)C2=CC=C(C=C2)N)(C)C)C |
Product Overview
4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline (CAS 405277-41-0), with molecular formula C13H19NO2 and molecular weight 221.14 g/mol. IUPAC: 4-(4,4,5,5-tetramethyl-1,3-dioxolan-2-yl)aniline.
Chemical Property Profile of 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline
Property Insights of 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline
The XLogP value of 2.8714 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline. With a topological polar surface area (TPSA) of 44.48 Ų, 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline has 1 hydrogen bond donor(s) and 3 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 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline?
The CAS number of 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline is 405277-41-0.
What is the molecular formula of 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline?
The molecular formula of 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline is C13H19NO2.
What is the molecular weight of 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline?
The molecular weight of 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline is 221.14 g/mol.
Where can I buy 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline?
You can request a quote for 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-(4,4,5,5-Tetramethyl-1,3-dioxolan-2-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.