2,3-Didehydrobutyrine
TL;DR: 2,3-Didehydrobutyrine (CAS 65940-97-8) is a chemical compound with molecular formula C4H7NO2 and molecular weight 101.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-aminobut-2-enoic acid
Also Known As: 2,3-didehydrobutyrine, 2-Butenoic acid, amino-, alpha,beta-Dehydroaminobutyric acid
| Molecular Formula | C4H7NO2 |
|---|---|
| Molecular Weight | 101.05 g/mol |
| LogP | -0.0665 |
| Topological Polar Surface Area | 63.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 101.047676 |
| Heavy Atoms | 7 |
| Complexity | 106.25742 |
Chemical Identifiers
| CAS Number | 65940-97-8 |
|---|---|
| SMILES | CC=C(C(=O)O)N |
Product Overview
2,3-Didehydrobutyrine (CAS 65940-97-8), with molecular formula C4H7NO2 and molecular weight 101.05 g/mol. IUPAC: 2-aminobut-2-enoic acid.
Chemical Property Profile of 2,3-Didehydrobutyrine
Property Insights of 2,3-Didehydrobutyrine
The XLogP value of -0.0665 indicates that 2,3-Didehydrobutyrine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Didehydrobutyrine. Following Lipinski's Rule of Five, 2,3-Didehydrobutyrine has 2 hydrogen bond donor(s) and 2 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 2,3-Didehydrobutyrine?
The CAS number of 2,3-Didehydrobutyrine is 65940-97-8.
What is the molecular formula of 2,3-Didehydrobutyrine?
The molecular formula of 2,3-Didehydrobutyrine is C4H7NO2.
What is the molecular weight of 2,3-Didehydrobutyrine?
The molecular weight of 2,3-Didehydrobutyrine is 101.05 g/mol.
Where can I buy 2,3-Didehydrobutyrine?
You can request a quote for 2,3-Didehydrobutyrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Didehydrobutyrine?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Didehydrobutyrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.