bis(5-methoxy-1-benzofuran-2-yl)methanone

C19H14O5 — CID 13454368

IUPACbis(5-methoxy-1-benzofuran-2-yl)methanone
SMILESCOc1ccc2oc(C(=O)c3cc4cc(OC)ccc4o3)cc2c1
InChIInChI=1S/C19H14O5/c1-21-13-3-5-15-11(7-13)9-17(23-15)19(20)18-10-12-8-14(22-2)4-6-16(12)24-18/h3-10H,1-2H3
InChIKeyHEAUVWMQZFRPLK-UHFFFAOYSA-N
MW322.32 g/mol
LogP4.43
Rot. Bonds4

About bis(5-methoxy-1-benzofuran-2-yl)methanone

bis(5-methoxy-1-benzofuran-2-yl)methanone (PubChem CID 13454368) has the molecular formula C19H14O5 and a molecular weight of 322.32 g/mol. Its IUPAC name is bis(5-methoxy-1-benzofuran-2-yl)methanone.

Molecular Properties

Compound Namebis(5-methoxy-1-benzofuran-2-yl)methanone
PubChem CID13454368
Molecular FormulaC19H14O5
Molecular Weight322.32 g/mol
Exact Mass322.08
IUPAC Namebis(5-methoxy-1-benzofuran-2-yl)methanone
SMILESCOc1ccc2oc(C(=O)c3cc4cc(OC)ccc4o3)cc2c1
InChIInChI=1S/C19H14O5/c1-21-13-3-5-15-11(7-13)9-17(23-15)19(20)18-10-12-8-14(22-2)4-6-16(12)24-18/h3-10H,1-2H3
InChIKeyHEAUVWMQZFRPLK-UHFFFAOYSA-N
XLogP4.43
TPSA61.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.32
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of bis(5-methoxy-1-benzofuran-2-yl)methanone?
The IUPAC name of bis(5-methoxy-1-benzofuran-2-yl)methanone (CID 13454368) is bis(5-methoxy-1-benzofuran-2-yl)methanone.
What is the SMILES notation for bis(5-methoxy-1-benzofuran-2-yl)methanone?
The canonical SMILES for bis(5-methoxy-1-benzofuran-2-yl)methanone is COc1ccc2oc(C(=O)c3cc4cc(OC)ccc4o3)cc2c1.
What is the InChIKey of bis(5-methoxy-1-benzofuran-2-yl)methanone?
The InChIKey is HEAUVWMQZFRPLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14O5/c1-21-13-3-5-15-11(7-13)9-17(23-15)19(20)18-10-12-8-14(22-2)4-6-16(12)24-18/h3-10H,1-2H3.
What are the key properties of bis(5-methoxy-1-benzofuran-2-yl)methanone?
bis(5-methoxy-1-benzofuran-2-yl)methanone has a molecular weight of 322.32 g/mol, XLogP of 4.43, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(5-methoxy-1-benzofuran-2-yl)methanone is sourced from PubChem (CID 13454368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).