3-phenylmethoxy-2-(phenylmethoxymethyl)furan

C19H18O3 — CID 14859945

IUPAC3-phenylmethoxy-2-(phenylmethoxymethyl)furan
SMILESc1ccc(COCc2occc2OCc2ccccc2)cc1
InChIInChI=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
InChIKeyIIXNTCJKGNQLIA-UHFFFAOYSA-N
MW294.35 g/mol
LogP4.58
Rot. Bonds7

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 Name3-phenylmethoxy-2-(phenylmethoxymethyl)furan
PubChem CID14859945
Molecular FormulaC19H18O3
Molecular Weight294.35 g/mol
Exact Mass294.13
IUPAC Name3-phenylmethoxy-2-(phenylmethoxymethyl)furan
SMILESc1ccc(COCc2occc2OCc2ccccc2)cc1
InChIInChI=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
InChIKeyIIXNTCJKGNQLIA-UHFFFAOYSA-N
XLogP4.58
TPSA31.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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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).