2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan

C24H22O4 — CID 102127806

IUPAC2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan
SMILESc1ccc(COCc2ccc(-c3ccc(COCc4ccccc4)o3)o2)cc1
InChIInChI=1S/C24H22O4/c1-3-7-19(8-4-1)15-25-17-21-11-13-23(27-21)24-14-12-22(28-24)18-26-16-20-9-5-2-6-10-20/h1-14H,15-18H2
InChIKeyBYSGMHDQXTWPBB-UHFFFAOYSA-N
MW374.44 g/mol
LogP5.97
Rot. Bonds9

About 2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan

2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan (PubChem CID 102127806) has the molecular formula C24H22O4 and a molecular weight of 374.44 g/mol. Its IUPAC name is 2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan.

Molecular Properties

Compound Name2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan
PubChem CID102127806
Molecular FormulaC24H22O4
Molecular Weight374.44 g/mol
Exact Mass374.15
IUPAC Name2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan
SMILESc1ccc(COCc2ccc(-c3ccc(COCc4ccccc4)o3)o2)cc1
InChIInChI=1S/C24H22O4/c1-3-7-19(8-4-1)15-25-17-21-11-13-23(27-21)24-14-12-22(28-24)18-26-16-20-9-5-2-6-10-20/h1-14H,15-18H2
InChIKeyBYSGMHDQXTWPBB-UHFFFAOYSA-N
XLogP5.97
TPSA44.74 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.44
LogP ≤ 55.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(phenylmethoxymethyl)furan-2-carbaldehyde
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3-[5-[2,4-dihydroxy-6-(phenylmethoxymethyl)phenyl]furan-2-yl]propanoic acid
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Frequently Asked Questions

What is the IUPAC name of 2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan?
The IUPAC name of 2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan (CID 102127806) is 2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan.
What is the SMILES notation for 2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan?
The canonical SMILES for 2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan is c1ccc(COCc2ccc(-c3ccc(COCc4ccccc4)o3)o2)cc1.
What is the InChIKey of 2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan?
The InChIKey is BYSGMHDQXTWPBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22O4/c1-3-7-19(8-4-1)15-25-17-21-11-13-23(27-21)24-14-12-22(28-24)18-26-16-20-9-5-2-6-10-20/h1-14H,15-18H2.
What are the key properties of 2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan?
2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan has a molecular weight of 374.44 g/mol, XLogP of 5.97, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(phenylmethoxymethyl)-5-[5-(phenylmethoxymethyl)furan-2-yl]furan is sourced from PubChem (CID 102127806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).