(5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one

C17H12O4 — CID 11587235

IUPAC(5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one
SMILESO=C1C=C(c2ccc(O)cc2)/C(=C/c2ccc(O)cc2)O1
InChIInChI=1S/C17H12O4/c18-13-5-1-11(2-6-13)9-16-15(10-17(20)21-16)12-3-7-14(19)8-4-12/h1-10,18-19H/b16-9-
InChIKeyXWHVMFUBZGOZKD-SXGWCWSVSA-N
MW280.28 g/mol
LogP3.08
Rot. Bonds2

About (5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one

(5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one (PubChem CID 11587235) has the molecular formula C17H12O4 and a molecular weight of 280.28 g/mol. Its IUPAC name is (5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one.

Molecular Properties

Compound Name(5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one
PubChem CID11587235
Molecular FormulaC17H12O4
Molecular Weight280.28 g/mol
Exact Mass280.07
IUPAC Name(5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one
SMILESO=C1C=C(c2ccc(O)cc2)/C(=C/c2ccc(O)cc2)O1
InChIInChI=1S/C17H12O4/c18-13-5-1-11(2-6-13)9-16-15(10-17(20)21-16)12-3-7-14(19)8-4-12/h1-10,18-19H/b16-9-
InChIKeyXWHVMFUBZGOZKD-SXGWCWSVSA-N
XLogP3.08
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.28
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one?
The IUPAC name of (5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one (CID 11587235) is (5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one.
What is the SMILES notation for (5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one?
The canonical SMILES for (5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one is O=C1C=C(c2ccc(O)cc2)/C(=C/c2ccc(O)cc2)O1.
What is the InChIKey of (5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one?
The InChIKey is XWHVMFUBZGOZKD-SXGWCWSVSA-N. The full InChI is InChI=1S/C17H12O4/c18-13-5-1-11(2-6-13)9-16-15(10-17(20)21-16)12-3-7-14(19)8-4-12/h1-10,18-19H/b16-9-.
What are the key properties of (5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one?
(5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one has a molecular weight of 280.28 g/mol, XLogP of 3.08, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-4-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one is sourced from PubChem (CID 11587235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).