Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1)
TL;DR: Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1) (CAS 72863-11-7) is a chemical compound with molecular formula C8H15NO4 and molecular weight 189.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azane;ethyl prop-2-enoate;prop-2-enoic acid
Also Known As: azane; ethyl prop-2-enoate; prop-2-enoic acid, (C5-H8-O2.C3-H4-O2)x-.x-H3-N, 2-Propenoic acid, polymer with ethyl 2-propenoate, ammonium salt, Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1)
| Molecular Formula | C8H15NO4 |
|---|---|
| Molecular Weight | 189.10 g/mol |
| LogP | 1.1545 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 189.10011 |
| Heavy Atoms | 13 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 72863-11-7 |
|---|---|
| SMILES | CCOC(=O)C=C.C=CC(=O)O.N |
| InChIKey | VNUDNQYYVXMVJL-UHFFFAOYSA-N |
Product Overview
Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1) (CAS 72863-11-7), with molecular formula C8H15NO4 and molecular weight 189.10 g/mol. IUPAC: azane;ethyl prop-2-enoate;prop-2-enoic acid.
Chemical Property Profile of Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1)
Property Insights of Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1)
The XLogP value of 1.1545 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1). The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1). Following Lipinski's Rule of Five, Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1) has 2 hydrogen bond donor(s) and 5 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 Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1)?
The CAS number of Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1) is 72863-11-7.
What is the molecular formula of Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1)?
The molecular formula of Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1) is C8H15NO4.
What is the molecular weight of Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1)?
The molecular weight of Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1) is 189.10 g/mol.
Where can I buy Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1)?
You can request a quote for Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1)?
Yes, KEHONG BIO provides custom synthesis services for Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.