5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1)
TL;DR: 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1) (CAS 64037-27-0) is a chemical compound with molecular formula C64H62N4O9 and molecular weight 1030.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetrakis(2-(2-phenyl-1,3-benzoxazol-5-yl)propan-1-ol);hydrate
Also Known As: 2-Phenyl-beta-methyl-5-benzoxazoleethanol hydrate, C16H15NO2.1/4H2O, C16-H15-N-O2.1/4H2-O, 5-BENZOXAZOLEETHANOL, beta-METHYL-2-PHENYL-, HYDRATE (4:1), 2-(2-phenyl-1,3-benzoxazol-5-yl)propan-1-ol hydrate
| Molecular Formula | C64H62N4O9 |
|---|---|
| Molecular Weight | 1030.45 g/mol |
| LogP | 13.54 |
| Topological Polar Surface Area | 186.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 12 |
| Exact Mass | 1030.4517 |
| Heavy Atoms | 77 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 64037-27-0 |
|---|---|
| SMILES | CC(CO)C1=CC2=C(C=C1)OC(=N2)C3=CC=CC=C3.CC(CO)C1=CC2=C(C=C1)OC(=N2)C3=CC=CC=C3.CC(CO)C1=CC2=C(C=C1)OC(=N2)C3=CC=CC=C3.CC(CO)C1=CC2=C(C=C1)OC(=N2)C3=CC=CC=C3.O |
| InChIKey | CFZVHPKDNFUKEV-UHFFFAOYSA-N |
Product Overview
5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1) (CAS 64037-27-0), with molecular formula C64H62N4O9 and molecular weight 1030.45 g/mol. IUPAC: tetrakis(2-(2-phenyl-1,3-benzoxazol-5-yl)propan-1-ol);hydrate.
Chemical Property Profile of 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1)
Property Insights of 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1)
The XLogP value of 13.54 indicates that 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 186.0 Ų indicates high polarity, suggesting 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1) has 5 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1)?
The CAS number of 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1) is 64037-27-0.
What is the molecular formula of 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1)?
The molecular formula of 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1) is C64H62N4O9.
What is the molecular weight of 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1)?
The molecular weight of 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1) is 1030.45 g/mol.
Where can I buy 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1)?
You can request a quote for 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1)?
Yes, KEHONG BIO provides custom synthesis services for 5-Benzoxazoleethanol, beta-methyl-2-phenyl-, hydrate (4:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.