2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol
TL;DR: 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol (CAS 727675-29-8) is a chemical compound with molecular formula C13H17NO3 and molecular weight 235.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(hydroxymethyl)-2-(2-phenylethyl)-5H-1,3-oxazol-4-yl]methanol
Also Known As: [2-(2-phenylethyl)-4,5-dihydro-1,3-oxazole-4,4-diyl]dimethanol|(2-Phenethyl-4,5-dihydrooxazole-4,4-diyl)dimethanol|2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol|4,4(5H)-oxazoledimethanol, 2-(2-phenylethyl)-|[4-(hydroxymethyl)-2-(2-phenylethyl)-5H-1,3-oxazol-4-yl]methanol|4,4-Oxazoledimethanol, 4,5-dihydro-2-(2-phenylethyl)-|A3768/0159838|[4-(hydroxymethyl)-2-(2-phenylethyl)-4,5-dihydro-1,3-oxazol-4-yl]methanol|[4-(hydroxymethyl)-2-(2-phenylethyl)-5H-oxazol-4-yl]methanol|[4-(hydroxymethyl)-2-phenethyl-5H-1,3-oxazol-4-yl]methanol|2-(2-Phenylethyl)-4,5-dihydro-1,3-oxazole-4,4-diyldimethanol|[4-(hydroxymethyl)-2-(2-phenylethyl)-1,3-oxazolin-4-yl]methan-1-ol|[4-(HYDROXYMETHYL)-2-PHENETHYL-4,5-DIHYDRO-1,3-OXAZOL-4-YL]METHANOL|RefChem:251059|MFCD05860809|MLS001163066|PNVVXUBQUOVXNS-UHFFFAOYSA-N|ALBB-026073|SMR000499381
| Molecular Formula | C13H17NO3 |
|---|---|
| Molecular Weight | 235.12 g/mol |
| LogP | 0.7713 |
| Topological Polar Surface Area | 62.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 235.12085 |
| Heavy Atoms | 17 |
| Complexity | 384.91086 |
Chemical Identifiers
| CAS Number | 727675-29-8 |
|---|---|
| SMILES | C1C(N=C(O1)CCC2=CC=CC=C2)(CO)CO |
Product Overview
2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol (CAS 727675-29-8), with molecular formula C13H17NO3 and molecular weight 235.12 g/mol. IUPAC: [4-(hydroxymethyl)-2-(2-phenylethyl)-5H-1,3-oxazol-4-yl]methanol.
Chemical Property Profile of 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol
Property Insights of 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol
The XLogP value of 0.7713 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol. The TPSA of 62.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol. Following Lipinski's Rule of Five, 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol has 2 hydrogen bond donor(s) and 4 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 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol?
The CAS number of 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol is 727675-29-8.
What is the molecular formula of 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol?
The molecular formula of 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol is C13H17NO3.
What is the molecular weight of 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol?
The molecular weight of 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol is 235.12 g/mol.
Where can I buy 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol?
You can request a quote for 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Phenylethyl)-4,4(5H)-oxazoledimethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.