2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan

C32H24O — CID 146495264

IUPAC2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan
SMILESCC1(C)c2ccccc2C2(c3ccccc3-c3ccccc32)c2ccc(-c3ccco3)cc21
InChIInChI=1S/C32H24O/c1-31(2)26-14-7-8-15-27(26)32(28-18-17-21(20-29(28)31)30-16-9-19-33-30)24-12-5-3-10-22(24)23-11-4-6-13-25(23)32/h3-20H,1-2H3
InChIKeyHHEKPCAYNIKNJA-UHFFFAOYSA-N
MW424.54 g/mol
LogP7.95
Rot. Bonds1

About 2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan

2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan (PubChem CID 146495264) has the molecular formula C32H24O and a molecular weight of 424.54 g/mol. Its IUPAC name is 2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan.

Molecular Properties

Compound Name2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan
PubChem CID146495264
Molecular FormulaC32H24O
Molecular Weight424.54 g/mol
Exact Mass424.18
IUPAC Name2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan
SMILESCC1(C)c2ccccc2C2(c3ccccc3-c3ccccc32)c2ccc(-c3ccco3)cc21
InChIInChI=1S/C32H24O/c1-31(2)26-14-7-8-15-27(26)32(28-18-17-21(20-29(28)31)30-16-9-19-33-30)24-12-5-3-10-22(24)23-11-4-6-13-25(23)32/h3-20H,1-2H3
InChIKeyHHEKPCAYNIKNJA-UHFFFAOYSA-N
XLogP7.95
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.54
LogP ≤ 57.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[3'-[(1Z)-buta-1,3-dienyl]-2',4',4'-trimethylspiro[fluorene-9,1'-naphthalene]-3-yl]furan
CID 166995728
4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)pyridine
CID 146495231
CID 140720702
CID 140720702
2-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)phenyl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 146495829
9,9-dimethylspiro[anthracene-10,9'-fluorene]-3'-amine
CID 142504362
9,9,10,10-tetramethyl-2,6-bis(2-phenylphenyl)anthracene
CID 59649045
4-[4-(9,9-dimethylfluoren-1-yl)phenyl]-2-(furan-2-yl)-6-(4-phenylphenyl)pyrimidine
CID 130465590
3-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]aniline
CID 167176335
N-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)phenyl]-N-phenyl-4-triphenylen-2-ylaniline
CID 167177462
2-[2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)phenyl]-4,6-bis(3-phenylphenyl)-1,3,5-triazine
CID 166996046
2-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-3'-yl)phenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 146494836
2-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-3'-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 142504402

Frequently Asked Questions

What is the IUPAC name of 2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan?
The IUPAC name of 2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan (CID 146495264) is 2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan.
What is the SMILES notation for 2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan?
The canonical SMILES for 2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan is CC1(C)c2ccccc2C2(c3ccccc3-c3ccccc32)c2ccc(-c3ccco3)cc21.
What is the InChIKey of 2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan?
The InChIKey is HHEKPCAYNIKNJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H24O/c1-31(2)26-14-7-8-15-27(26)32(28-18-17-21(20-29(28)31)30-16-9-19-33-30)24-12-5-3-10-22(24)23-11-4-6-13-25(23)32/h3-20H,1-2H3.
What are the key properties of 2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan?
2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan has a molecular weight of 424.54 g/mol, XLogP of 7.95, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)furan is sourced from PubChem (CID 146495264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).