About 3-phenylmethoxy-2-(phenylmethoxymethyl)furan
3-phenylmethoxy-2-(phenylmethoxymethyl)furan (PubChem CID 14859945) has the molecular formula C19H18O3
and a molecular weight of 294.35 g/mol. Its IUPAC name is 3-phenylmethoxy-2-(phenylmethoxymethyl)furan.
Molecular Properties
| Compound Name | 3-phenylmethoxy-2-(phenylmethoxymethyl)furan |
| PubChem CID | 14859945 |
| Molecular Formula | C19H18O3 |
| Molecular Weight | 294.35 g/mol |
| Exact Mass | 294.13 |
| IUPAC Name | 3-phenylmethoxy-2-(phenylmethoxymethyl)furan |
| SMILES | c1ccc(COCc2occc2OCc2ccccc2)cc1 |
| InChI | InChI=1S/C19H18O3/c1-3-7-16(8-4-1)13-20-15-19-18(11-12-21-19)22-14-17-9-5-2-6-10-17/h1-12H,13-15H2 |
| InChIKey | IIXNTCJKGNQLIA-UHFFFAOYSA-N |
| XLogP | 4.58 |
| TPSA | 31.60 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 294.35 |
| LogP ≤ 5 | 4.58 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 3-phenylmethoxy-2-(phenylmethoxymethyl)furan?
The IUPAC name of 3-phenylmethoxy-2-(phenylmethoxymethyl)furan (CID 14859945) is 3-phenylmethoxy-2-(phenylmethoxymethyl)furan.
What is the SMILES notation for 3-phenylmethoxy-2-(phenylmethoxymethyl)furan?
The canonical SMILES for 3-phenylmethoxy-2-(phenylmethoxymethyl)furan is c1ccc(COCc2occc2OCc2ccccc2)cc1.
What is the InChIKey of 3-phenylmethoxy-2-(phenylmethoxymethyl)furan?
The InChIKey is IIXNTCJKGNQLIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18O3/c1-3-7-16(8-4-1)13-20-15-19-18(11-12-21-19)22-14-17-9-5-2-6-10-17/h1-12H,13-15H2.
What are the key properties of 3-phenylmethoxy-2-(phenylmethoxymethyl)furan?
3-phenylmethoxy-2-(phenylmethoxymethyl)furan has a molecular weight of 294.35 g/mol, XLogP of 4.58, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenylmethoxy-2-(phenylmethoxymethyl)furan is sourced from PubChem (CID 14859945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).