![3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid structure](/static/products/1417/1417623-59-6.webp)
3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid
TL;DR: 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid (CAS 1417623-59-6) is a chemical compound with molecular formula C7H7NO3 and molecular weight 153.04259 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-oxo-4-(prop-2-ynylamino)but-2-enoic acid
Also Known As: 3-(Prop-2-yn-1-ylcarbamoyl)acrylic acid, 3-(N-PROP-2-YNYLCARBAMOYL)PROP-2-ENOIC ACID, 3-[(prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid, 3-(prop-2-ynylcarbamoyl)prop-2-enoic Acid, 4-Oxo-4-(prop-2-yn-1-ylamino)but-2-enoic acid
Technical Specifications
| Molecular Formula | C7H7NO3 |
| Molecular Weight | 153.04259 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 153.04259 Da |
| Heavy Atoms | 11 |
| Complexity | 233.0 |
| SMILES | C#CCNC(=O)C=CC(=O)O |
| InChIKey | HALRXTZFQAPCDC-UHFFFAOYSA-N |
Chemical Property Profile of 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid
Property Insights of 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid
The XLogP value of -0.6 indicates that 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid. Following Lipinski's Rule of Five, 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid has 2 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 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid?
The CAS number of 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid is 1417623-59-6.
What is the molecular formula of 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid?
The molecular formula of 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid is C7H7NO3.
What is the molecular weight of 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid?
The molecular weight of 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid is 153.04259 g/mol.
Where can I buy 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid?
You can request a quote for 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid?
Yes, CoreyChem provides custom synthesis services for 3-[(Prop-2-yn-1-yl)carbamoyl]prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.