9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol

C39H26O2 — CID 163459929

IUPAC9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol
SMILESOC1(c2c(-c3cccc4c5c(oc34)C=CCC5)c3ccccc3c3ccccc23)c2ccccc2-c2ccccc21
InChIInChI=1S/C39H26O2/c40-39(33-21-8-5-14-26(33)27-15-6-9-22-34(27)39)37-30-18-4-2-13-25(30)24-12-1-3-17-29(24)36(37)32-20-11-19-31-28-16-7-10-23-35(28)41-38(31)32/h1-6,8-15,17-23,40H,7,16H2
InChIKeyBNRZNXUPXUQZNC-UHFFFAOYSA-N
MW526.64 g/mol
LogP9.63
Rot. Bonds2

About 9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol

9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol (PubChem CID 163459929) has the molecular formula C39H26O2 and a molecular weight of 526.64 g/mol. Its IUPAC name is 9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol.

Molecular Properties

Compound Name9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol
PubChem CID163459929
Molecular FormulaC39H26O2
Molecular Weight526.64 g/mol
Exact Mass526.19
IUPAC Name9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol
SMILESOC1(c2c(-c3cccc4c5c(oc34)C=CCC5)c3ccccc3c3ccccc23)c2ccccc2-c2ccccc21
InChIInChI=1S/C39H26O2/c40-39(33-21-8-5-14-26(33)27-15-6-9-22-34(27)39)37-30-18-4-2-13-25(30)24-12-1-3-17-29(24)36(37)32-20-11-19-31-28-16-7-10-23-35(28)41-38(31)32/h1-6,8-15,17-23,40H,7,16H2
InChIKeyBNRZNXUPXUQZNC-UHFFFAOYSA-N
XLogP9.63
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500526.64
LogP ≤ 59.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol with MolForge

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Related Compounds

6-(10-phenylanthracen-9-yl)-1,2-dihydrodibenzofuran
CID 87631578
6-(10-pyren-1-ylanthracen-9-yl)-1,2-dihydrodibenzofuran
CID 88564296
6-bromo-1,2-dihydrodibenzofuran
CID 121420689
8,9-dihydrodibenzofuran-4-ylboronic acid
CID 123567559
spiro[1,2-dihydrofluoreno[2,3-b][1]benzofuran-7,9'-fluorene]
CID 155257133
2-[3-(8,9-dihydrodibenzofuran-4-yl)phenyl]-3-(2,4,6-trimethylphenyl)phenanthro[9,10-b]pyrazine
CID 88905815
4-[4-[8-[4-(8,9-dihydrodibenzofuran-4-yl)phenyl]pyren-1-yl]phenyl]dibenzofuran
CID 88912607
6-[9,9-dimethyl-7-(2-methylsulfanylphenyl)sulfanylfluoren-2-yl]-1,2-dihydrodibenzofuran
CID 145441970
ethane;N-phenyl-8,9-dihydrodibenzofuran-4-amine
CID 145105452
9-(3-anthracen-9-ylphenyl)-3-(8,9-dihydrodibenzofuran-4-yl)carbazole
CID 87171652
spiro[fluorene-9,16'-heptacyclo[15.12.0.02,15.03,8.09,14.018,23.024,29]nonacosa-1(17),2(15),3,5,7,9,11,13,18,20,22,24,26,28-tetradecaene]
CID 155624644
9-anthracen-9-ylfluoren-9-ol
CID 72942304

Frequently Asked Questions

What is the IUPAC name of 9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol?
The IUPAC name of 9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol (CID 163459929) is 9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol.
What is the SMILES notation for 9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol?
The canonical SMILES for 9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol is OC1(c2c(-c3cccc4c5c(oc34)C=CCC5)c3ccccc3c3ccccc23)c2ccccc2-c2ccccc21.
What is the InChIKey of 9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol?
The InChIKey is BNRZNXUPXUQZNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H26O2/c40-39(33-21-8-5-14-26(33)27-15-6-9-22-34(27)39)37-30-18-4-2-13-25(30)24-12-1-3-17-29(24)36(37)32-20-11-19-31-28-16-7-10-23-35(28)41-38(31)32/h1-6,8-15,17-23,40H,7,16H2.
What are the key properties of 9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol?
9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol has a molecular weight of 526.64 g/mol, XLogP of 9.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[10-(8,9-dihydrodibenzofuran-4-yl)phenanthren-9-yl]fluoren-9-ol is sourced from PubChem (CID 163459929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).