2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid
TL;DR: 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid (CAS 56584-01-1) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethenyl-2,4,4-trimethylpentanoic acid
Also Known As: 2-methyl-2-neopentyl-3-butenoic acid, 2-ethenyl-2,4,4-trimethylpentanoic acid, 2-ethenyl-2,4,4-trimethyl-pentanoic Acid, 3,5,5-trimethyl-1-hexene-3-carboxylic acid, 2-(2,2-dimethylpropyl)-2-methylbut-3-enoic acid
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 2.6995 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 188.50548 |
Chemical Identifiers
| CAS Number | 56584-01-1 |
|---|---|
| SMILES | CC(C)(C)CC(C)(C=C)C(=O)O |
Product Overview
2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid (CAS 56584-01-1), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: 2-ethenyl-2,4,4-trimethylpentanoic acid.
Chemical Property Profile of 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid
Property Insights of 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid
The XLogP value of 2.6995 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid has 1 hydrogen bond donor(s) and 1 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-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid?
The CAS number of 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid is 56584-01-1.
What is the molecular formula of 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid?
The molecular formula of 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid is C10H18O2.
What is the molecular weight of 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid?
The molecular weight of 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid is 170.13 g/mol.
Where can I buy 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid?
You can request a quote for 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,2-Dimethylpropyl)-2-methylbut-3-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.