7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran

C32H19FO — CID 122634660

IUPAC7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran
SMILESFc1cc(-c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)cc2ccoc12
InChIInChI=1S/C32H19FO/c33-29-19-22(18-21-16-17-34-32(21)29)30-25-11-3-5-13-27(25)31(28-14-6-4-12-26(28)30)24-15-7-9-20-8-1-2-10-23(20)24/h1-19H
InChIKeyGPGLWQWXEANHCQ-UHFFFAOYSA-N
MW438.50 g/mol
LogP9.37
Rot. Bonds2

About 7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran

7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran (PubChem CID 122634660) has the molecular formula C32H19FO and a molecular weight of 438.50 g/mol. Its IUPAC name is 7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran.

Molecular Properties

Compound Name7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran
PubChem CID122634660
Molecular FormulaC32H19FO
Molecular Weight438.50 g/mol
Exact Mass438.14
IUPAC Name7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran
SMILESFc1cc(-c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)cc2ccoc12
InChIInChI=1S/C32H19FO/c33-29-19-22(18-21-16-17-34-32(21)29)30-25-11-3-5-13-27(25)31(28-14-6-4-12-26(28)30)24-15-7-9-20-8-1-2-10-23(20)24/h1-19H
InChIKeyGPGLWQWXEANHCQ-UHFFFAOYSA-N
XLogP9.37
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500438.50
LogP ≤ 59.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

9-naphthalen-1-yl-10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracene
CID 58876135
9-(6-naphthalen-1-ylnaphthalen-1-yl)-10-phenylanthracene
CID 123682471
8-(10-naphthalen-1-ylanthracen-9-yl)-[1]benzothiolo[2,3-g][1]benzofuran
CID 176745707
9-naphthalen-1-yl-10-(3-phenanthren-2-ylphenyl)anthracene
CID 58194236
9-(2-fluorophenyl)-10-naphthalen-1-ylanthracene
CID 155682787
ethane;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene
CID 91401240
9-naphthalen-1-yl-10-[3-(4-naphthalen-1-ylphenyl)phenyl]anthracene
CID 142696935
9-naphthalen-1-yl-10-[6-(6-naphthalen-1-ylnaphthalen-2-yl)naphthalen-2-yl]anthracene
CID 123515173
9-naphthalen-1-yl-2-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-10-phenylanthracene
CID 59557553
9-naphthalen-1-yl-10-[3-[8-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]phenyl]anthracene
CID 168786914
9-naphthalen-1-yl-10-[7-[3-[3-(3-phenylphenyl)phenyl]phenyl]naphthalen-2-yl]anthracene
CID 140855946
9-(4-chlorophenyl)-10-naphthalen-1-ylanthracene
CID 145157949

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran?
The IUPAC name of 7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran (CID 122634660) is 7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran.
What is the SMILES notation for 7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran?
The canonical SMILES for 7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran is Fc1cc(-c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)cc2ccoc12.
What is the InChIKey of 7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran?
The InChIKey is GPGLWQWXEANHCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H19FO/c33-29-19-22(18-21-16-17-34-32(21)29)30-25-11-3-5-13-27(25)31(28-14-6-4-12-26(28)30)24-15-7-9-20-8-1-2-10-23(20)24/h1-19H.
What are the key properties of 7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran?
7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran has a molecular weight of 438.50 g/mol, XLogP of 9.37, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-5-(10-naphthalen-1-ylanthracen-9-yl)-1-benzofuran is sourced from PubChem (CID 122634660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).