![[3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid structure](/static/products/937/93777-26-5.png)
[3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid
TL;DR: [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid (CAS 93777-26-5) is a chemical compound with molecular formula C12H18O3 and molecular weight 210.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(2-hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid
Also Known As: [3-(2-hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid|2-[3-(2-hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid|2-(3-(2-hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl)acetic acid|MLS002608713|FZCUXHXSOMOLQL-UHFFFAOYSA-N|SMR001527457
| Molecular Formula | C12H18O3 |
|---|---|
| Molecular Weight | 210.13 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.1256 |
| Heavy Atoms | 15 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 93777-26-5 |
|---|---|
| SMILES | CC1(C(CC1C(C)(C#C)O)CC(=O)O)C |
| InChIKey | FZCUXHXSOMOLQL-UHFFFAOYSA-N |
Product Overview
[3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid (CAS 93777-26-5), with molecular formula C12H18O3 and molecular weight 210.13 g/mol. IUPAC: 2-[3-(2-hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid.
Chemical Property Profile of [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid
Property Insights of [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid. With a topological polar surface area (TPSA) of 57.5 Ų, [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid has 2 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 [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid?
The CAS number of [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid is 93777-26-5.
What is the molecular formula of [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid?
The molecular formula of [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid is C12H18O3.
What is the molecular weight of [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid?
The molecular weight of [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid is 210.13 g/mol.
Where can I buy [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid?
You can request a quote for [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [3-(2-Hydroxybut-3-yn-2-yl)-2,2-dimethylcyclobutyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.