2-(3-chloro-5-phenylphenyl)-1-benzofuran

C20H13ClO — CID 144661171

IUPAC2-(3-chloro-5-phenylphenyl)-1-benzofuran
SMILESClc1cc(-c2ccccc2)cc(-c2cc3ccccc3o2)c1
InChIInChI=1S/C20H13ClO/c21-18-11-16(14-6-2-1-3-7-14)10-17(12-18)20-13-15-8-4-5-9-19(15)22-20/h1-13H
InChIKeyOPIGRHOOUYIFFW-UHFFFAOYSA-N
MW304.78 g/mol
LogP6.42
Rot. Bonds2

About 2-(3-chloro-5-phenylphenyl)-1-benzofuran

2-(3-chloro-5-phenylphenyl)-1-benzofuran (PubChem CID 144661171) has the molecular formula C20H13ClO and a molecular weight of 304.78 g/mol. Its IUPAC name is 2-(3-chloro-5-phenylphenyl)-1-benzofuran.

Molecular Properties

Compound Name2-(3-chloro-5-phenylphenyl)-1-benzofuran
PubChem CID144661171
Molecular FormulaC20H13ClO
Molecular Weight304.78 g/mol
Exact Mass304.07
IUPAC Name2-(3-chloro-5-phenylphenyl)-1-benzofuran
SMILESClc1cc(-c2ccccc2)cc(-c2cc3ccccc3o2)c1
InChIInChI=1S/C20H13ClO/c21-18-11-16(14-6-2-1-3-7-14)10-17(12-18)20-13-15-8-4-5-9-19(15)22-20/h1-13H
InChIKeyOPIGRHOOUYIFFW-UHFFFAOYSA-N
XLogP6.42
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.78
LogP ≤ 56.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[3-(4-chlorophenyl)phenyl]-1-benzofuran
CID 170402405
2-(3-bromo-5-chlorophenyl)-1-benzofuran
CID 144661039
N-[4-[3-(1-benzofuran-2-yl)phenyl]phenyl]-4-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 170398057
N-[4-[3-(1-benzofuran-2-yl)phenyl]phenyl]-N,4-diphenylaniline
CID 170526268
N-[4-[3-(1-benzofuran-2-yl)phenyl]phenyl]-3,5-diphenyl-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline
CID 170398270
N-[3-(1-benzofuran-2-yl)phenyl]-3,5-diphenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 170398609
N-[4-[2-(1-benzofuran-2-yl)phenyl]phenyl]-N-(3,5-diphenylphenyl)-3,5-diphenylaniline
CID 170398415
4-[3-(1-benzofuran-2-yl)phenyl]-N-[4-(3-phenylphenyl)phenyl]-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline
CID 170398268
2-[4-[(E)-2-(4-chlorophenyl)ethenyl]phenyl]-1-benzofuran
CID 88836846
2-[4-(1-benzofuran-2-yl)phenyl]-4-(2-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 146183190
2-[4-(1-benzofuran-2-yl)-2,5-dichlorophenyl]-1-benzofuran
CID 67296045
4-[4-(1-benzofuran-2-yl)phenyl]-N-[4-[4-(1-benzofuran-2-yl)phenyl]phenyl]-N-phenylaniline
CID 164744662

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-5-phenylphenyl)-1-benzofuran?
The IUPAC name of 2-(3-chloro-5-phenylphenyl)-1-benzofuran (CID 144661171) is 2-(3-chloro-5-phenylphenyl)-1-benzofuran.
What is the SMILES notation for 2-(3-chloro-5-phenylphenyl)-1-benzofuran?
The canonical SMILES for 2-(3-chloro-5-phenylphenyl)-1-benzofuran is Clc1cc(-c2ccccc2)cc(-c2cc3ccccc3o2)c1.
What is the InChIKey of 2-(3-chloro-5-phenylphenyl)-1-benzofuran?
The InChIKey is OPIGRHOOUYIFFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13ClO/c21-18-11-16(14-6-2-1-3-7-14)10-17(12-18)20-13-15-8-4-5-9-19(15)22-20/h1-13H.
What are the key properties of 2-(3-chloro-5-phenylphenyl)-1-benzofuran?
2-(3-chloro-5-phenylphenyl)-1-benzofuran has a molecular weight of 304.78 g/mol, XLogP of 6.42, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-5-phenylphenyl)-1-benzofuran is sourced from PubChem (CID 144661171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).