Propionic acid, 2-(3-chloro-4-methallylaminophenyl)-
TL;DR: Propionic acid, 2-(3-chloro-4-methallylaminophenyl)- (CAS 71589-41-8) is a chemical compound with molecular formula C13H16ClNO2 and molecular weight 253.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-chloro-4-(2-methylprop-2-enylamino)phenyl]propanoic acid
Also Known As: 2-(3-Chloro-4-methallylaminophenyl)propionic acid, 2-[3-chloro-4- phenyl]propanoicacid, Propionic acid, 2-(3-chloro-4-methallylaminophenyl)-, 2-[3-chloro-4-(2-methylprop-2-enylamino)phenyl]propanoic acid, 2-[3-Chloro-4-(methallylamino)phenyl]propionic acid
| Molecular Formula | C13H16ClNO2 |
|---|---|
| Molecular Weight | 253.09 g/mol |
| LogP | 3.5161 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 253.08696 |
| Heavy Atoms | 17 |
| Complexity | 443.04565 |
Chemical Identifiers
| CAS Number | 71589-41-8 |
|---|---|
| SMILES | CC(C1=CC(=C(C=C1)NCC(=C)C)Cl)C(=O)O |
Product Overview
Propionic acid, 2-(3-chloro-4-methallylaminophenyl)- (CAS 71589-41-8), with molecular formula C13H16ClNO2 and molecular weight 253.09 g/mol. IUPAC: 2-[3-chloro-4-(2-methylprop-2-enylamino)phenyl]propanoic acid.
Chemical Property Profile of Propionic acid, 2-(3-chloro-4-methallylaminophenyl)-
Property Insights of Propionic acid, 2-(3-chloro-4-methallylaminophenyl)-
The XLogP value of 3.5161 indicates that Propionic acid, 2-(3-chloro-4-methallylaminophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, Propionic acid, 2-(3-chloro-4-methallylaminophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propionic acid, 2-(3-chloro-4-methallylaminophenyl)- has 2 hydrogen bond donor(s) and 2 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 Propionic acid, 2-(3-chloro-4-methallylaminophenyl)-?
The CAS number of Propionic acid, 2-(3-chloro-4-methallylaminophenyl)- is 71589-41-8.
What is the molecular formula of Propionic acid, 2-(3-chloro-4-methallylaminophenyl)-?
The molecular formula of Propionic acid, 2-(3-chloro-4-methallylaminophenyl)- is C13H16ClNO2.
What is the molecular weight of Propionic acid, 2-(3-chloro-4-methallylaminophenyl)-?
The molecular weight of Propionic acid, 2-(3-chloro-4-methallylaminophenyl)- is 253.09 g/mol.
Where can I buy Propionic acid, 2-(3-chloro-4-methallylaminophenyl)-?
You can request a quote for Propionic acid, 2-(3-chloro-4-methallylaminophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propionic acid, 2-(3-chloro-4-methallylaminophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Propionic acid, 2-(3-chloro-4-methallylaminophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.