2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol

C17H14O3 — CID 101035333

IUPAC2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol
SMILESC/C=C/c1ccc2oc(-c3ccc(O)cc3)c(O)c2c1
InChIInChI=1S/C17H14O3/c1-2-3-11-4-9-15-14(10-11)16(19)17(20-15)12-5-7-13(18)8-6-12/h2-10,18-19H,1H3/b3-2+
InChIKeyLSCXHUVULICXSR-NSCUHMNNSA-N
MW266.30 g/mol
LogP4.54
Rot. Bonds2

About 2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol

2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol (PubChem CID 101035333) has the molecular formula C17H14O3 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol.

Molecular Properties

Compound Name2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol
PubChem CID101035333
Molecular FormulaC17H14O3
Molecular Weight266.30 g/mol
Exact Mass266.09
IUPAC Name2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol
SMILESC/C=C/c1ccc2oc(-c3ccc(O)cc3)c(O)c2c1
InChIInChI=1S/C17H14O3/c1-2-3-11-4-9-15-14(10-11)16(19)17(20-15)12-5-7-13(18)8-6-12/h2-10,18-19H,1H3/b3-2+
InChIKeyLSCXHUVULICXSR-NSCUHMNNSA-N
XLogP4.54
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 54.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-6-[4-[3-methyl-5-[(E)-prop-1-enyl]-1-benzofuran-2-yl]phenoxy]oxane-3,4,5-triol
CID 5357968
(2R,3S,4S,5S,6S)-2-methyl-6-[4-[3-methyl-5-[(E)-prop-1-enyl]-1-benzofuran-2-yl]phenoxy]oxane-3,4,5-triol
CID 163185722
5-methyl-2-phenyl-1-benzofuran-3-ol
CID 71372497
4-[5-(hydroxymethyl)-3-methyl-1-benzofuran-2-yl]phenol
CID 14213217
3,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one;methane
CID 157253645
3,7-dihydroxy-2-(4-hydroxyphenyl)-6-(3-methylbut-2-enyl)chromen-4-one
CID 24825781
4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol
CID 139612412
(3,5-dimethylphenyl)-[2-(4-hydroxyphenyl)-5-methyl-1-benzofuran-3-yl]methanone
CID 21488054
2-[[2-hydroxy-5-(4-hydroxyphenyl)phenyl]-[4-[(E)-prop-1-enyl]phenyl]methyl]-4-(4-hydroxyphenyl)phenol
CID 163458586
4-(7-methoxy-5-prop-1-enyl-1-benzofuran-2-yl)phenol
CID 162961364
2-(4-hydroxyphenyl)-3-methylchromen-4-one
CID 11579699
4-(4-prop-1-enylphenyl)sulfonylphenol
CID 67220481

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol?
The IUPAC name of 2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol (CID 101035333) is 2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol.
What is the SMILES notation for 2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol?
The canonical SMILES for 2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol is C/C=C/c1ccc2oc(-c3ccc(O)cc3)c(O)c2c1.
What is the InChIKey of 2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol?
The InChIKey is LSCXHUVULICXSR-NSCUHMNNSA-N. The full InChI is InChI=1S/C17H14O3/c1-2-3-11-4-9-15-14(10-11)16(19)17(20-15)12-5-7-13(18)8-6-12/h2-10,18-19H,1H3/b3-2+.
What are the key properties of 2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol?
2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol has a molecular weight of 266.30 g/mol, XLogP of 4.54, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenyl)-5-[(E)-prop-1-enyl]-1-benzofuran-3-ol is sourced from PubChem (CID 101035333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).