10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione

C17H10O5 — CID 162982307

IUPAC10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione
SMILESC=C(C)c1cc2c(o1)C(=O)c1c(cc3ccoc3c1O)C2=O
InChIInChI=1S/C17H10O5/c1-7(2)11-6-10-13(18)9-5-8-3-4-21-16(8)14(19)12(9)15(20)17(10)22-11/h3-6,19H,1H2,2H3
InChIKeyUIPQLRGGCGCEKR-UHFFFAOYSA-N
MW294.26 g/mol
LogP3.54
Rot. Bonds1

About 10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione

10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione (PubChem CID 162982307) has the molecular formula C17H10O5 and a molecular weight of 294.26 g/mol. Its IUPAC name is 10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione.

Molecular Properties

Compound Name10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione
PubChem CID162982307
Molecular FormulaC17H10O5
Molecular Weight294.26 g/mol
Exact Mass294.05
IUPAC Name10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione
SMILESC=C(C)c1cc2c(o1)C(=O)c1c(cc3ccoc3c1O)C2=O
InChIInChI=1S/C17H10O5/c1-7(2)11-6-10-13(18)9-5-8-3-4-21-16(8)14(19)12(9)15(20)17(10)22-11/h3-6,19H,1H2,2H3
InChIKeyUIPQLRGGCGCEKR-UHFFFAOYSA-N
XLogP3.54
TPSA80.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.26
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quinone_A(370)', 'substructure': 'N/A'}

Analyze 10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione with MolForge

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Related Compounds

2-acetyl-7-chloro-5-hydroxybenzo[f][1]benzofuran-4,9-dione
CID 134544093
2-acetyl-5-chloro-7-hydroxybenzo[f][1]benzofuran-4,9-dione
CID 134540876
1,4,5,6-tetrahydroxyxanthen-3-one
CID 118495757
9-(3-methylbut-3-enoxy)furo[3,2-g]chromen-7-one
CID 88593145
5,6,7-trihydroxy-3-methylbenzo[f][2]benzofuran-4,9-dione
CID 137276862
4,9-dioxobenzo[f][1]benzofuran-2-carboxylic acid
CID 58260130
4-hydroxy-2-prop-1-en-2-yl-1-benzofuran-5-carbaldehyde
CID 10878218
acetaldehyde;1-benzofuran-7-ol
CID 87738813
11,12-dihydroxy-15-phenyl-14-oxatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2,4,6,9,11,13(16)-heptaen-8-one
CID 71439122
3-(furan-2-yl)-7,8-dihydroxychromen-2-one
CID 23371929
2-[4-methoxy-2-[(7-prop-1-en-2-yl-1-benzofuran-5-yl)methoxy]phenyl]acetic acid
CID 153350239
2-acetylbenzo[f][1]benzofuran-4,9-dione;2-acetyl-3-(bromomethyl)benzo[f][1]benzofuran-4,9-dione
CID 159036694

Frequently Asked Questions

What is the IUPAC name of 10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione?
The IUPAC name of 10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione (CID 162982307) is 10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione.
What is the SMILES notation for 10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione?
The canonical SMILES for 10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione is C=C(C)c1cc2c(o1)C(=O)c1c(cc3ccoc3c1O)C2=O.
What is the InChIKey of 10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione?
The InChIKey is UIPQLRGGCGCEKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10O5/c1-7(2)11-6-10-13(18)9-5-8-3-4-21-16(8)14(19)12(9)15(20)17(10)22-11/h3-6,19H,1H2,2H3.
What are the key properties of 10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione?
10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione has a molecular weight of 294.26 g/mol, XLogP of 3.54, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10-hydroxy-7-prop-1-en-2-yl-[1]benzofuro[5,6-f][1]benzofuran-5,9-dione is sourced from PubChem (CID 162982307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).