spiro[4,4a-dihydrofluorene-9,9'-fluorene]

C25H18 — CID 154012789

IUPACspiro[4,4a-dihydrofluorene-9,9'-fluorene]
SMILESC1=CCC2C(=C1)C1(c3ccccc3-c3ccccc31)c1ccccc12
InChIInChI=1S/C25H18/c1-5-13-21-17(9-1)18-10-2-6-14-22(18)25(21)23-15-7-3-11-19(23)20-12-4-8-16-24(20)25/h1-11,13-16,20H,12H2
InChIKeyBQPKUDKUSSYXBL-UHFFFAOYSA-N
MW318.42 g/mol
LogP5.98
Rot. Bonds

About spiro[4,4a-dihydrofluorene-9,9'-fluorene]

spiro[4,4a-dihydrofluorene-9,9'-fluorene] (PubChem CID 154012789) has the molecular formula C25H18 and a molecular weight of 318.42 g/mol. Its IUPAC name is spiro[4,4a-dihydrofluorene-9,9'-fluorene].

Molecular Properties

Compound Namespiro[4,4a-dihydrofluorene-9,9'-fluorene]
PubChem CID154012789
Molecular FormulaC25H18
Molecular Weight318.42 g/mol
Exact Mass318.14
IUPAC Namespiro[4,4a-dihydrofluorene-9,9'-fluorene]
SMILESC1=CCC2C(=C1)C1(c3ccccc3-c3ccccc31)c1ccccc12
InChIInChI=1S/C25H18/c1-5-13-21-17(9-1)18-10-2-6-14-22(18)25(21)23-15-7-3-11-19(23)20-12-4-8-16-24(20)25/h1-11,13-16,20H,12H2
InChIKeyBQPKUDKUSSYXBL-UHFFFAOYSA-N
XLogP5.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.42
LogP ≤ 55.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

spiro[4,4a-dihydrofluorene-9,9'-xanthene]
CID 155576891
1-N,1-N,4-N-tris(4-phenylphenyl)-4-N-spiro[4,4a-dihydrofluorene-9,9'-fluorene]-1'-ylbenzene-1,4-diamine
CID 71249416
4-[9-(4-hydroxy-3-prop-2-enylphenyl)-4,4a-dihydrofluoren-9-yl]-2-prop-2-enylphenol
CID 130371878
4-(9-phenyl-4,4a-dihydrofluoren-9-yl)dibenzothiophene
CID 70991495
2,4-diphenyl-6-[4-(4-spiro[4,4a-dihydrofluorene-9,9'-fluorene]-3'-ylphenyl)phenyl]pyridine;2,4-diphenyl-6-[3-[4-(9,9'-spirobi[fluorene]-3-yl)phenyl]phenyl]pyridine;2,4-diphenyl-6-[4-[3-(9,9'-spirobi[fluorene]-3-yl)phenyl]phenyl]pyridine;2-[3-[3-(9-methyl-9-phenylfluoren-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[4-(9-methyl-9-phenylfluoren-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 159276468
N,4-diphenyl-N-(4-spiro[4b,5-dihydrofluorene-9,12'-fluoreno[2,1-b][1]benzothiole]-1-ylphenyl)aniline
CID 130380191
1-N,1-N-diphenyl-8-N-[4-(9-phenyl-4,4a-dihydrofluoren-9-yl)phenyl]-8-N-(4'-phenylspiro[fluorene-9,9'-xanthene]-2'-yl)dibenzofuran-1,8-diamine
CID 168799235
2-(9,9-difluoro-4b,5-dihydrofluoren-2-yl)-4,6-dinaphthalen-1-ylpyrimidine
CID 135247112
4-[4-[7'-[cyclohexa-2,4-dien-1-yl(phenyl)phosphoryl]spiro[4,4a-dihydrofluorene-9,9'-fluorene]-2'-yl]phenyl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaene
CID 123979711
N-[3-[7-[3-[(9,9-dimethyl-4b,5-dihydrofluoren-2-yl)-(9,9-dimethylfluoren-2-yl)amino]phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-N-(9,9-dimethyl-3,4-dihydrofluoren-2-yl)-9,9-dimethylfluoren-2-amine
CID 89356016
2-(9,9-dimethyl-4b,5-dihydrofluoren-1-yl)-4,6-bis(3,5-diphenylphenyl)pyrimidine
CID 145237161
spiro[9H-anthracene-10,9'-fluorene]-9-carbaldehyde
CID 175453260

Frequently Asked Questions

What is the IUPAC name of spiro[4,4a-dihydrofluorene-9,9'-fluorene]?
The IUPAC name of spiro[4,4a-dihydrofluorene-9,9'-fluorene] (CID 154012789) is spiro[4,4a-dihydrofluorene-9,9'-fluorene].
What is the SMILES notation for spiro[4,4a-dihydrofluorene-9,9'-fluorene]?
The canonical SMILES for spiro[4,4a-dihydrofluorene-9,9'-fluorene] is C1=CCC2C(=C1)C1(c3ccccc3-c3ccccc31)c1ccccc12.
What is the InChIKey of spiro[4,4a-dihydrofluorene-9,9'-fluorene]?
The InChIKey is BQPKUDKUSSYXBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18/c1-5-13-21-17(9-1)18-10-2-6-14-22(18)25(21)23-15-7-3-11-19(23)20-12-4-8-16-24(20)25/h1-11,13-16,20H,12H2.
What are the key properties of spiro[4,4a-dihydrofluorene-9,9'-fluorene]?
spiro[4,4a-dihydrofluorene-9,9'-fluorene] has a molecular weight of 318.42 g/mol, XLogP of 5.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[4,4a-dihydrofluorene-9,9'-fluorene] is sourced from PubChem (CID 154012789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).