Brn 4603272
TL;DR: Brn 4603272 (CAS 126454-05-5) is a chemical compound with molecular formula C29H48O7 and molecular weight 508.34 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[3-(5-ethyl-5-hydroxy-6-methyloxan-2-yl)-15-hydroxy-3,10,12-trimethyl-4,6,8-trioxadispiro[4.1.57.35]pentadec-13-en-9-yl]hexan-3-one
Also Known As: 3-Hexanone, 4-(2-(5-ethyltetrahydro-5-hydroxy-6-methyl-2H-pyran-2-yl)-15-hydroxy-2,10,12-trimethyl-1,6,8-trioxadispiro(4.1.5.3)pentadec-13-en-9-yl)-, 4-[2-(5-Ethyl-5-hydroxy-6-methyloxan-2-yl)-15-hydroxy-2,10,12-trimethyl-1,6,8-trioxadispiro[4.1.5~7~.3~5~]pentadec-13-en-9-yl]hexan-3-one, 4-[3-(5-ethyl-5-hydroxy-6-methyloxan-2-yl)-15-hydroxy-3,10,12-trimethyl-4,6,8-trioxadispiro[4.1.5^{7}.3^{5}]pentadec-13-en-9-yl]hexan-3-one, BRN 4603272
Technical Specifications
| Molecular Formula | C29H48O7 |
| Molecular Weight | 508.34 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 94.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 508.34 Da |
| Heavy Atoms | 36 |
| Complexity | 845.0 |
| SMILES | CCC(C1C(CC(C2(O1)C=CC(C3(O2)CCC(O3)(C)C4CCC(C(O4)C)(CC)O)O)C)C)C(=O)CC |
| InChIKey | IIJUJSZXIGNQKP-UHFFFAOYSA-N |
Chemical Property Profile of Brn 4603272
Property Insights of Brn 4603272
The XLogP value of 3.8 indicates that Brn 4603272 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Brn 4603272. Following Lipinski's Rule of Five, Brn 4603272 has 2 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 Brn 4603272?
The CAS number of Brn 4603272 is 126454-05-5.
What is the molecular formula of Brn 4603272?
The molecular formula of Brn 4603272 is C29H48O7.
What is the molecular weight of Brn 4603272?
The molecular weight of Brn 4603272 is 508.34 g/mol.
Where can I buy Brn 4603272?
You can request a quote for Brn 4603272 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Brn 4603272?
Yes, CoreyChem provides custom synthesis services for Brn 4603272 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.