7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran

C27H20O — CID 158538604

IUPAC7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran
SMILESCC1(C)c2ccccc2-c2cc3c(cc21)oc1c(-c2ccccc2)cccc13
InChIInChI=1S/C27H20O/c1-27(2)23-14-7-6-11-19(23)21-15-22-20-13-8-12-18(17-9-4-3-5-10-17)26(20)28-25(22)16-24(21)27/h3-16H,1-2H3
InChIKeyVQAUPFBTGFEQBN-UHFFFAOYSA-N
MW360.46 g/mol
LogP7.56
Rot. Bonds1

About 7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran

7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran (PubChem CID 158538604) has the molecular formula C27H20O and a molecular weight of 360.46 g/mol. Its IUPAC name is 7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran.

Molecular Properties

Compound Name7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran
PubChem CID158538604
Molecular FormulaC27H20O
Molecular Weight360.46 g/mol
Exact Mass360.15
IUPAC Name7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran
SMILESCC1(C)c2ccccc2-c2cc3c(cc21)oc1c(-c2ccccc2)cccc13
InChIInChI=1S/C27H20O/c1-27(2)23-14-7-6-11-19(23)21-15-22-20-13-8-12-18(17-9-4-3-5-10-17)26(20)28-25(22)16-24(21)27/h3-16H,1-2H3
InChIKeyVQAUPFBTGFEQBN-UHFFFAOYSA-N
XLogP7.56
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.46
LogP ≤ 57.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(11,11-dimethylfluoreno[3,2-b][1]benzofuran-4-yl)-4,6-diphenyl-1,3,5-triazine
CID 130233245
4-[3-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-4-yl)phenyl]-2,6-diphenylpyrimidine
CID 140907204
2-[4-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-4-yl)phenyl]-3-phenylimidazo[1,2-a]pyridine
CID 166591220
N-(9,9-dimethylfluoren-2-yl)-18-phenyl-N-[2-(4-phenylphenyl)phenyl]-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-8-amine
CID 171050332
4-(23,23-dimethyl-5-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17,19,21-dodecaenyl)dibenzofuran
CID 118472826
4-[3-(23,23-dimethyl-5-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17,19,21-dodecaenyl)phenyl]dibenzofuran
CID 121444171
N-(9,9-dimethylfluoren-2-yl)-18-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-8-amine
CID 171050362
2-(11,11-dimethylfluoreno[3,2-b][1]benzofuran-4-yl)-4,6-diphenyl-1,3,5-triazine;2-[3-(11,11-dimethylfluoreno[3,2-b][1]benzofuran-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[4-(11,11-dimethylfluoreno[3,2-b][1]benzofuran-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 159465808
N,N-bis(9,9-dimethylfluoren-2-yl)-6-phenyldibenzofuran-1-amine
CID 176607730
4-tert-butyl-N-(9,9-dimethylfluoren-2-yl)-7,7-dimethyl-N-(4-phenylphenyl)fluoreno[2,3-b][1]benzofuran-9-amine
CID 176821917
3-(9,9-dimethylfluoren-2-yl)-7,7-dimethylfluoreno[2,3-b][1]benzofuran;4-(9,9-dimethylfluoren-2-yl)-7,7-dimethylfluoreno[2,3-b][1]benzofuran;7,7-dimethyl-1-triphenylen-2-ylfluoreno[2,3-b][1]benzofuran;7,7-dimethyl-2-triphenylen-2-ylfluoreno[2,3-b][1]benzofuran;7,7-dimethyl-3-triphenylen-2-ylfluoreno[2,3-b][1]benzofuran;7,7-dimethyl-4-triphenylen-2-ylfluoreno[2,3-b][1]benzofuran
CID 160855811
11,11-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)fluoreno[3,2-b][1]benzofuran-4-amine
CID 134393027

Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran?
The IUPAC name of 7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran (CID 158538604) is 7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran.
What is the SMILES notation for 7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran?
The canonical SMILES for 7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran is CC1(C)c2ccccc2-c2cc3c(cc21)oc1c(-c2ccccc2)cccc13.
What is the InChIKey of 7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran?
The InChIKey is VQAUPFBTGFEQBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H20O/c1-27(2)23-14-7-6-11-19(23)21-15-22-20-13-8-12-18(17-9-4-3-5-10-17)26(20)28-25(22)16-24(21)27/h3-16H,1-2H3.
What are the key properties of 7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran?
7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran has a molecular weight of 360.46 g/mol, XLogP of 7.56, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-4-phenylfluoreno[2,3-b][1]benzofuran is sourced from PubChem (CID 158538604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).