3-(3-Chlorophenyl)-2-methyl-2-propenoicacid
TL;DR: 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid (CAS 109619-78-5) is a chemical compound with molecular formula C10H9ClO2 and molecular weight 196.02911 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-chlorophenyl)-2-methylprop-2-enoic acid
Also Known As: 3-(3-chlorophenyl)-2-methylprop-2-enoic acid, 5-(aminomethyl)-1-methylpyrrolidin-2-one, 3-(3-chlorophenyl)-2-methyl-prop-2-enoic Acid, 2-Propenoic acid, 3-(3-chlorophenyl)-2-methyl-, 2-Propenoic acid, 3-(3-chlorophenyl)-2-methyl-, (2E)-
Technical Specifications
| Molecular Formula | C10H9ClO2 |
| Molecular Weight | 196.02911 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.02911 Da |
| Heavy Atoms | 13 |
| Complexity | 223.0 |
| SMILES | CC(=CC1=CC(=CC=C1)Cl)C(=O)O |
| InChIKey | FCGZPQKRDHNWQS-UHFFFAOYSA-N |
Chemical Property Profile of 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid
Property Insights of 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid. With a topological polar surface area (TPSA) of 37.3 Ų, 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid has 1 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 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid?
The CAS number of 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid is 109619-78-5.
What is the molecular formula of 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid?
The molecular formula of 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid is C10H9ClO2.
What is the molecular weight of 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid?
The molecular weight of 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid is 196.02911 g/mol.
Where can I buy 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid?
You can request a quote for 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid?
Yes, CoreyChem provides custom synthesis services for 3-(3-Chlorophenyl)-2-methyl-2-propenoicacid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.