Chlorophyllone a
TL;DR: Chlorophyllone a (CAS 127266-93-7) is a chemical compound with molecular formula C33H32N4O3 and molecular weight 532.24744 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-ethenyl-12-ethyl-19,20-dihydroxy-6,11,26,27-tetramethyl-2,16,28,29-tetrazaheptacyclo[15.7.1.13,24.15,8.110,13.115,18.020,25]nonacosa-1(25),3,5(29),6,8,10(28),11,13,15(27),16,18-undecaen-21-one
Also Known As: Chlorophyllone a, 4,7-Imino-2,21-methano-14,16-metheno-9,12-nitrilo-15H-azuleno(1,8-bc)(1,5)diazacyclooctadecine-17,18(17aH,19H)-dione, 6-ethenyl-11-ethyl-20,21-dihydro-17a-hydroxy-5,10,22,23-tetramethyl-, (17aS-(17aR*,21R*,22R*))-
Technical Specifications
| Molecular Formula | C33H32N4O3 |
| Molecular Weight | 532.24744 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 532.24744 Da |
| Heavy Atoms | 40 |
| Complexity | 1740.0 |
| SMILES | CCC1=C(C2=NC1=CC3=C(C4=C(C5(C(=O)CCC6C(C(=CC7=NC(=C2)C(=C7C)C=C)NC6=C5C4=N3)C)O)O)C)C |
| InChIKey | BSUBVJVWWWPFAA-UHFFFAOYSA-N |
Chemical Property Profile of Chlorophyllone a
Property Insights of Chlorophyllone a
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chlorophyllone a. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Chlorophyllone a. Following Lipinski's Rule of Five, Chlorophyllone a has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Chlorophyllone a?
The CAS number of Chlorophyllone a is 127266-93-7.
What is the molecular formula of Chlorophyllone a?
The molecular formula of Chlorophyllone a is C33H32N4O3.
What is the molecular weight of Chlorophyllone a?
The molecular weight of Chlorophyllone a is 532.24744 g/mol.
Where can I buy Chlorophyllone a?
You can request a quote for Chlorophyllone a directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Chlorophyllone a?
Yes, CoreyChem provides custom synthesis services for Chlorophyllone a and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.