2-Cyanopropanoic acid
TL;DR: 2-Cyanopropanoic acid (CAS 632-07-5) is a chemical compound with molecular formula C4H5NO2 and molecular weight 99.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyanopropanoic acid
Also Known As: 2-cyanopropanoic acid, Propanoic acid, 2-cyano-, 2-CYANOPROPIONIC ACID, 2-cyano-2-methylacetic acid, 2-cyanopropanoicacid
| Molecular Formula | C4H5NO2 |
|---|---|
| Molecular Weight | 99.03 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 61.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 99.03203 |
| Heavy Atoms | 7 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 632-07-5 |
|---|---|
| SMILES | CC(C#N)C(=O)O |
| InChIKey | JDEFPFLTCXIVDH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Cyanopropanoic acid (CAS 632-07-5), with molecular formula C4H5NO2 and molecular weight 99.03 g/mol. IUPAC: 2-cyanopropanoic acid.
Chemical Property Profile of 2-Cyanopropanoic acid
Property Insights of 2-Cyanopropanoic acid
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyanopropanoic acid. The TPSA of 61.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyanopropanoic acid. Following Lipinski's Rule of Five, 2-Cyanopropanoic acid has 1 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 2-Cyanopropanoic acid?
The CAS number of 2-Cyanopropanoic acid is 632-07-5.
What is the molecular formula of 2-Cyanopropanoic acid?
The molecular formula of 2-Cyanopropanoic acid is C4H5NO2.
What is the molecular weight of 2-Cyanopropanoic acid?
The molecular weight of 2-Cyanopropanoic acid is 99.03 g/mol.
Where can I buy 2-Cyanopropanoic acid?
You can request a quote for 2-Cyanopropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyanopropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyanopropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.