![Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate structure](/static/products/1213/1213940-30-7.webp)
Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate
TL;DR: Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate (CAS 1213940-30-7) is a chemical compound with molecular formula C13H19NO2 and molecular weight 221.14159 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-amino-3-(4-propan-2-ylphenyl)propanoate
Also Known As: methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate, methyl 3-amino-3-(4-isopropylphenyl)propanoate, Methyl 3-amino-3-(4-propan-2-ylphenyl)propanoate, Methyl-3-amino-3-(4-isopropylphenyl)propionate, Methyl (s)-3-amino-3-(4-isopropylphenyl)propanoate
Technical Specifications
| Molecular Formula | C13H19NO2 |
| Molecular Weight | 221.14159 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 221.14159 Da |
| Heavy Atoms | 16 |
| Complexity | 220.0 |
| SMILES | CC(C)C1=CC=C(C=C1)C(CC(=O)OC)N |
| InChIKey | LMGBGJYWZRQZMX-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate
Property Insights of Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate. With a topological polar surface area (TPSA) of 52.3 Ų, Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate 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
What is the CAS number of Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate?
The CAS number of Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate is 1213940-30-7.
What is the molecular formula of Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate?
The molecular formula of Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate is C13H19NO2.
What is the molecular weight of Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate?
The molecular weight of Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate is 221.14159 g/mol.
Where can I buy Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate?
You can request a quote for Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate?
Yes, CoreyChem provides custom synthesis services for Methyl 3-amino-3-[4-(propan-2-yl)phenyl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.