3-(Prop-2-enylcarbamoyl)prop-2-enoic acid
TL;DR: 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid (CAS 925-02-0) is a chemical compound with molecular formula C7H9NO3 and molecular weight 155.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-4-(prop-2-enylamino)but-2-enoic acid
Also Known As: 3-(prop-2-enylcarbamoyl)prop-2-enoic acid, 4-oxo-4-(prop-2-enylamino)but-2-enoic acid, NCI60_011348, (Z)-3-(prop-2-enylcarbamoyl)prop-2-enoic acid, 4-Oxo-4-(2-propen-1-ylamino)-2-butenoic acid
| Molecular Formula | C7H9NO3 |
|---|---|
| Molecular Weight | 155.06 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 155.05824 |
| Heavy Atoms | 11 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 925-02-0 |
|---|---|
| SMILES | C=CCNC(=O)C=CC(=O)O |
| InChIKey | SZYZSIWKJQRNIE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Prop-2-enylcarbamoyl)prop-2-enoic acid (CAS 925-02-0), with molecular formula C7H9NO3 and molecular weight 155.06 g/mol. IUPAC: 4-oxo-4-(prop-2-enylamino)but-2-enoic acid.
Chemical Property Profile of 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid
Property Insights of 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid. Following Lipinski's Rule of Five, 3-(Prop-2-enylcarbamoyl)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
Frequently Asked Questions
What is the CAS number of 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid?
The CAS number of 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid is 925-02-0.
What is the molecular formula of 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid?
The molecular formula of 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid is C7H9NO3.
What is the molecular weight of 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid?
The molecular weight of 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid is 155.06 g/mol.
Where can I buy 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid?
You can request a quote for 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Prop-2-enylcarbamoyl)prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.