4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol

C20H14O3 — CID 139612412

IUPAC4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol
SMILESOc1ccc(-c2oc3ccccc3c2-c2ccc(O)cc2)cc1
InChIInChI=1S/C20H14O3/c21-15-9-5-13(6-10-15)19-17-3-1-2-4-18(17)23-20(19)14-7-11-16(22)12-8-14/h1-12,21-22H
InChIKeyGVBOZZMAXOUJKT-UHFFFAOYSA-N
MW302.33 g/mol
LogP5.18
Rot. Bonds2

About 4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol

4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol (PubChem CID 139612412) has the molecular formula C20H14O3 and a molecular weight of 302.33 g/mol. Its IUPAC name is 4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol.

Molecular Properties

Compound Name4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol
PubChem CID139612412
Molecular FormulaC20H14O3
Molecular Weight302.33 g/mol
Exact Mass302.09
IUPAC Name4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol
SMILESOc1ccc(-c2oc3ccccc3c2-c2ccc(O)cc2)cc1
InChIInChI=1S/C20H14O3/c21-15-9-5-13(6-10-15)19-17-3-1-2-4-18(17)23-20(19)14-7-11-16(22)12-8-14/h1-12,21-22H
InChIKeyGVBOZZMAXOUJKT-UHFFFAOYSA-N
XLogP5.18
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.33
LogP ≤ 55.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-bis(4-fluorophenyl)-1-benzofuran
CID 71732324
3-(4-hydroxyphenyl)-2-(4-methylsulfonylphenyl)chromen-4-one
CID 18324893
2,3-diphenyl-1-benzofuran;2-hydroxyacetic acid
CID 70599531
6,11-bis(4-methylphenyl)indeno[1,2-c]chromene
CID 71490854
2-(4-hydroxyphenyl)-3-methylchromen-4-one
CID 11579699
2,6-ditert-butyl-4-(2-phenyl-1-benzofuran-3-yl)phenol
CID 12618650
2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-3-phenyl-1-benzofuran
CID 121336223
3,5-bis(4-hydroxyphenyl)-2-phenylchromen-4-one
CID 161104453
3-(3,5-dimethoxyphenyl)-2-(4-methoxyphenyl)-1-benzofuran
CID 71608239
[3-(4-chlorophenyl)-1-benzofuran-2-yl]-(4-hydroxyphenyl)methanone
CID 21435341
2-(2-phenyl-1-benzofuran-3-yl)benzonitrile
CID 154714478
[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]-(4-methoxyphenyl)methanone
CID 54105837

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol?
The IUPAC name of 4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol (CID 139612412) is 4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol.
What is the SMILES notation for 4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol?
The canonical SMILES for 4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol is Oc1ccc(-c2oc3ccccc3c2-c2ccc(O)cc2)cc1.
What is the InChIKey of 4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol?
The InChIKey is GVBOZZMAXOUJKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14O3/c21-15-9-5-13(6-10-15)19-17-3-1-2-4-18(17)23-20(19)14-7-11-16(22)12-8-14/h1-12,21-22H.
What are the key properties of 4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol?
4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol has a molecular weight of 302.33 g/mol, XLogP of 5.18, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-hydroxyphenyl)-1-benzofuran-3-yl]phenol is sourced from PubChem (CID 139612412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).