(2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol

C15H11ClO2 — CID 24806533

IUPAC(2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol
SMILESOC1/C(=C/c2ccc(Cl)cc2)Oc2ccccc21
InChIInChI=1S/C15H11ClO2/c16-11-7-5-10(6-8-11)9-14-15(17)12-3-1-2-4-13(12)18-14/h1-9,15,17H/b14-9-
InChIKeyQRVIRFAOUJNUOZ-ZROIWOOFSA-N
MW258.70 g/mol
LogP3.81
Rot. Bonds1

About (2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol

(2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol (PubChem CID 24806533) has the molecular formula C15H11ClO2 and a molecular weight of 258.70 g/mol. Its IUPAC name is (2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol.

Molecular Properties

Compound Name(2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol
PubChem CID24806533
Molecular FormulaC15H11ClO2
Molecular Weight258.70 g/mol
Exact Mass258.04
IUPAC Name(2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol
SMILESOC1/C(=C/c2ccc(Cl)cc2)Oc2ccccc21
InChIInChI=1S/C15H11ClO2/c16-11-7-5-10(6-8-11)9-14-15(17)12-3-1-2-4-13(12)18-14/h1-9,15,17H/b14-9-
InChIKeyQRVIRFAOUJNUOZ-ZROIWOOFSA-N
XLogP3.81
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.70
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2E)-2-[(4-methylphenyl)methylidene]-3H-1-benzofuran-3-ol
CID 42638994
(3E)-3-[(4-chlorophenyl)methylidene]-4H-chromen-4-ol
CID 23266649
2-chloro-9H-xanthen-9-ol
CID 12734111
(2E)-2-benzylidene-5,7-dichloro-3H-1-benzofuran-3-ol
CID 177451465
(2Z,3R)-2-[(2-bromo-4,5-dimethoxyphenyl)methylidene]-3H-1-benzofuran-3-ol
CID 7374973
2-benzylidene-3H-1-benzofuran-3-carbaldehyde
CID 174224759
(2E)-2-[(4-chlorophenyl)methylidene]-1-benzofuran-3-one
CID 24762442
4-hydroxy-3-methylidene-4H-chromen-2-one
CID 21477201
3-chloro-5,6-dihydrobenzo[b][1]benzoxepin-6-ol
CID 78358085
(5S)-5H-chromeno[2,3-b]pyridin-5-ol
CID 51374273
[(2S,6S)-9-chloro-4-methyl-13-oxa-4-azoniatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),7(12),8,10,14,16-hexaen-4-yl]methanol
CID 58356879
(5Z)-5-[(4-chlorophenyl)methylidene]-3-(4-methyl-9H-xanthen-9-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
CID 5473901

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol?
The IUPAC name of (2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol (CID 24806533) is (2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol.
What is the SMILES notation for (2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol?
The canonical SMILES for (2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol is OC1/C(=C/c2ccc(Cl)cc2)Oc2ccccc21.
What is the InChIKey of (2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol?
The InChIKey is QRVIRFAOUJNUOZ-ZROIWOOFSA-N. The full InChI is InChI=1S/C15H11ClO2/c16-11-7-5-10(6-8-11)9-14-15(17)12-3-1-2-4-13(12)18-14/h1-9,15,17H/b14-9-.
What are the key properties of (2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol?
(2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol has a molecular weight of 258.70 g/mol, XLogP of 3.81, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-[(4-chlorophenyl)methylidene]-3H-1-benzofuran-3-ol is sourced from PubChem (CID 24806533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).