3-(2,3,5,6-四甲基苯基)丙酸
TL;DR: 3-(2,3,5,6-四甲基苯基)丙酸 (CAS 55683-10-8) is a chemical compound with molecular formula C13H18O2 and molecular weight 206.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,3,5,6-四甲基苯基)丙酸
3-(2,3,5,6-tetramethylphenyl)propanoic acid
Also Known As: 2-Pentyne,1-chloro-4,4-dimethyl, 3-(2,3,5,6-tetramethylphenyl)propanoic acid, TETRAMETHYLBENZENE PROPANOIC ACID
| Molecular Formula | C13H18O2 |
|---|---|
| Molecular Weight | 206.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.13068 |
| Heavy Atoms | 15 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 55683-10-8 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1C)CCC(=O)O)C)C |
| InChIKey | NRZIBHXUIOUVDC-UHFFFAOYSA-N |
Product Overview
3-(2,3,5,6-四甲基苯基)丙酸 (CAS 55683-10-8), with molecular formula C13H18O2 and molecular weight 206.13 g/mol. IUPAC: 3-(2,3,5,6-tetramethylphenyl)propanoic acid.
Chemical Property Profile of 3-(2,3,5,6-四甲基苯基)丙酸
Property Insights of 3-(2,3,5,6-四甲基苯基)丙酸
The XLogP value of 3.1 indicates that 3-(2,3,5,6-四甲基苯基)丙酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3-(2,3,5,6-四甲基苯基)丙酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,3,5,6-四甲基苯基)丙酸 has 1 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-(2,3,5,6-四甲基苯基)丙酸?
The CAS number of 3-(2,3,5,6-四甲基苯基)丙酸 is 55683-10-8.
What is the molecular formula of 3-(2,3,5,6-四甲基苯基)丙酸?
The molecular formula of 3-(2,3,5,6-四甲基苯基)丙酸 is C13H18O2.
What is the molecular weight of 3-(2,3,5,6-四甲基苯基)丙酸?
The molecular weight of 3-(2,3,5,6-四甲基苯基)丙酸 is 206.13 g/mol.
Where can I buy 3-(2,3,5,6-四甲基苯基)丙酸?
You can request a quote for 3-(2,3,5,6-四甲基苯基)丙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,3,5,6-四甲基苯基)丙酸?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,3,5,6-四甲基苯基)丙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.