(7-methoxy-1-benzofuran-4-yl) formate

C10H8O4 — CID 19261744

IUPAC(7-methoxy-1-benzofuran-4-yl) formate
SMILESCOc1ccc(OC=O)c2ccoc12
InChIInChI=1S/C10H8O4/c1-12-9-3-2-8(14-6-11)7-4-5-13-10(7)9/h2-6H,1H3
InChIKeyAYHYTYVERYFBKK-UHFFFAOYSA-N
MW192.17 g/mol
LogP1.98
Rot. Bonds3

About (7-methoxy-1-benzofuran-4-yl) formate

(7-methoxy-1-benzofuran-4-yl) formate (PubChem CID 19261744) has the molecular formula C10H8O4 and a molecular weight of 192.17 g/mol. Its IUPAC name is (7-methoxy-1-benzofuran-4-yl) formate.

Molecular Properties

Compound Name(7-methoxy-1-benzofuran-4-yl) formate
PubChem CID19261744
Molecular FormulaC10H8O4
Molecular Weight192.17 g/mol
Exact Mass192.04
IUPAC Name(7-methoxy-1-benzofuran-4-yl) formate
SMILESCOc1ccc(OC=O)c2ccoc12
InChIInChI=1S/C10H8O4/c1-12-9-3-2-8(14-6-11)7-4-5-13-10(7)9/h2-6H,1H3
InChIKeyAYHYTYVERYFBKK-UHFFFAOYSA-N
XLogP1.98
TPSA48.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.17
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (7-methoxy-1-benzofuran-4-yl) formate?
The IUPAC name of (7-methoxy-1-benzofuran-4-yl) formate (CID 19261744) is (7-methoxy-1-benzofuran-4-yl) formate.
What is the SMILES notation for (7-methoxy-1-benzofuran-4-yl) formate?
The canonical SMILES for (7-methoxy-1-benzofuran-4-yl) formate is COc1ccc(OC=O)c2ccoc12.
What is the InChIKey of (7-methoxy-1-benzofuran-4-yl) formate?
The InChIKey is AYHYTYVERYFBKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8O4/c1-12-9-3-2-8(14-6-11)7-4-5-13-10(7)9/h2-6H,1H3.
What are the key properties of (7-methoxy-1-benzofuran-4-yl) formate?
(7-methoxy-1-benzofuran-4-yl) formate has a molecular weight of 192.17 g/mol, XLogP of 1.98, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7-methoxy-1-benzofuran-4-yl) formate is sourced from PubChem (CID 19261744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).