3-methyl-2-(prop-2-enoylamino)butanoic Acid
TL;DR: 3-methyl-2-(prop-2-enoylamino)butanoic Acid (CAS 6973-30-4) is a chemical compound with molecular formula C8H13NO3 and molecular weight 171.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-(prop-2-enoylamino)butanoic acid
Also Known As: N-Acryloyl-DL-valine, N-(Prop-2-enoyl)valine, 3-methyl-2-(prop-2-enoylamino)butanoic Acid, 2-(Acryloylamino)isovaleric acid, N-(1-Oxo-2-propen-1-yl)valine
| Molecular Formula | C8H13NO3 |
|---|---|
| Molecular Weight | 171.09 g/mol |
| LogP | 0.3978 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 171.08954 |
| Heavy Atoms | 12 |
| Complexity | 198.47966 |
Chemical Identifiers
| CAS Number | 6973-30-4 |
|---|---|
| SMILES | CC(C)C(C(=O)O)NC(=O)C=C |
Product Overview
3-methyl-2-(prop-2-enoylamino)butanoic Acid (CAS 6973-30-4), with molecular formula C8H13NO3 and molecular weight 171.09 g/mol. IUPAC: 3-methyl-2-(prop-2-enoylamino)butanoic acid.
Chemical Property Profile of 3-methyl-2-(prop-2-enoylamino)butanoic Acid
Property Insights of 3-methyl-2-(prop-2-enoylamino)butanoic Acid
The XLogP value of 0.3978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-2-(prop-2-enoylamino)butanoic Acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-2-(prop-2-enoylamino)butanoic Acid. Following Lipinski's Rule of Five, 3-methyl-2-(prop-2-enoylamino)butanoic Acid 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 3-methyl-2-(prop-2-enoylamino)butanoic Acid?
The CAS number of 3-methyl-2-(prop-2-enoylamino)butanoic Acid is 6973-30-4.
What is the molecular formula of 3-methyl-2-(prop-2-enoylamino)butanoic Acid?
The molecular formula of 3-methyl-2-(prop-2-enoylamino)butanoic Acid is C8H13NO3.
What is the molecular weight of 3-methyl-2-(prop-2-enoylamino)butanoic Acid?
The molecular weight of 3-methyl-2-(prop-2-enoylamino)butanoic Acid is 171.09 g/mol.
Where can I buy 3-methyl-2-(prop-2-enoylamino)butanoic Acid?
You can request a quote for 3-methyl-2-(prop-2-enoylamino)butanoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-2-(prop-2-enoylamino)butanoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-2-(prop-2-enoylamino)butanoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.