Chamazulene Carboxylic Acid
TL;DR: Chamazulene Carboxylic Acid (CAS 489-87-2) is a chemical compound with molecular formula C15H16O2 and molecular weight 228.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(3,8-dimethylazulen-5-yl)propanoic acid
Also Known As: Chamazulenecarboxylic acid, Chamazulene carboxylic acid, (2S)-2-(3,8-dimethylazulen-5-yl)propanoic acid, (S)-Chamazulenecarboxylic acid, 5-Azuleneacetic acid, alpha,3,8-trimethyl-
| Molecular Formula | C15H16O2 |
|---|---|
| Molecular Weight | 228.12 g/mol |
| LogP | 3.59634 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.11504 |
| Heavy Atoms | 17 |
| Complexity | 543.0228 |
Chemical Identifiers
| CAS Number | 489-87-2 |
|---|---|
| SMILES | CC1=C2C=CC(=C2C=C(C=C1)[C@H](C)C(=O)O)C |
Product Overview
Chamazulene Carboxylic Acid (CAS 489-87-2), with molecular formula C15H16O2 and molecular weight 228.12 g/mol. IUPAC: (2S)-2-(3,8-dimethylazulen-5-yl)propanoic acid.
Chemical Property Profile of Chamazulene Carboxylic Acid
Property Insights of Chamazulene Carboxylic Acid
The XLogP value of 3.59634 indicates that Chamazulene Carboxylic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Chamazulene Carboxylic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chamazulene Carboxylic 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 Chamazulene Carboxylic Acid?
The CAS number of Chamazulene Carboxylic Acid is 489-87-2.
What is the molecular formula of Chamazulene Carboxylic Acid?
The molecular formula of Chamazulene Carboxylic Acid is C15H16O2.
What is the molecular weight of Chamazulene Carboxylic Acid?
The molecular weight of Chamazulene Carboxylic Acid is 228.12 g/mol.
Where can I buy Chamazulene Carboxylic Acid?
You can request a quote for Chamazulene Carboxylic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chamazulene Carboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for Chamazulene Carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.