9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene

C29H24 — CID 59217045

IUPAC9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(/C=C/c4ccccc4)cc3)cc21
InChIInChI=1S/C29H24/c1-29(2)27-11-7-6-10-25(27)26-19-18-24(20-28(26)29)23-16-14-22(15-17-23)13-12-21-8-4-3-5-9-21/h3-20H,1-2H3/b13-12+
InChIKeyXBDISHDQNPHLLF-OUKQBFOZSA-N
MW372.51 g/mol
LogP7.83
Rot. Bonds3

About 9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene

9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene (PubChem CID 59217045) has the molecular formula C29H24 and a molecular weight of 372.51 g/mol. Its IUPAC name is 9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene.

Molecular Properties

Compound Name9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene
PubChem CID59217045
Molecular FormulaC29H24
Molecular Weight372.51 g/mol
Exact Mass372.19
IUPAC Name9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(/C=C/c4ccccc4)cc3)cc21
InChIInChI=1S/C29H24/c1-29(2)27-11-7-6-10-25(27)26-19-18-24(20-28(26)29)23-16-14-22(15-17-23)13-12-21-8-4-3-5-9-21/h3-20H,1-2H3/b13-12+
InChIKeyXBDISHDQNPHLLF-OUKQBFOZSA-N
XLogP7.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.51
LogP ≤ 57.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

9,9-dimethyl-2,7-bis[4-[(E)-2-phenylethenyl]phenyl]fluorene
CID 59217271
9,9-dimethyl-2-naphthalen-2-yl-7-[4-[(E)-2-phenylethenyl]phenyl]fluorene
CID 59217060
9-(9,9-dimethylfluoren-2-yl)-10-[4-[2-(4-phenylphenyl)ethenyl]phenyl]anthracene
CID 123439671
9,9-dimethyl-2-naphthalen-2-yl-7-[6-(2-phenylethenyl)naphthalen-2-yl]fluorene
CID 72533469
9,9-dimethyl-N-phenyl-N-[4-[2-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]ethenyl]phenyl]fluoren-2-amine
CID 90889703
2-[3,5-bis[7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]-7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 101336380
2,7-bis[3,5-bis[3,5-bis(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-9,9-dimethylfluorene
CID 58881238
N-(9,9-dimethylfluoren-2-yl)-7-[(E)-2-[4-[4-[4-[(E)-2-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)-9,9-dimethylfluoren-2-yl]ethenyl]phenyl]phenyl]phenyl]ethenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 59246228
N,1-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]methanimine
CID 101463001
2-N,7-N-bis(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-2-N,7-N-bis[4-[(E)-2-phenylethenyl]phenyl]fluorene-2,7-diamine
CID 58883844
9,9-dimethyl-2-N,7-N-diphenyl-2-N-[4-(N-phenylanilino)phenyl]-7-N-[4-(2-phenylethenyl)phenyl]fluorene-2,7-diamine;1-N,1-N-diphenyl-4-N-[4-[4-[N-[4-(N-phenylanilino)phenyl]-4-(2-phenylethenyl)anilino]phenyl]phenyl]-4-N-[4-(2-phenylethenyl)phenyl]benzene-1,4-diamine;1-N,4-N-diphenyl-1-N-[4-(2-phenylethenyl)phenyl]-4-N-[4-(N-[4-(2-phenylethenyl)phenyl]anilino)phenyl]benzene-1,4-diamine;1-N,1-N-diphenyl-4-N-[4-(2-phenylethenyl)phenyl]-4-N-[4-[4-(N-[4-(2-phenylethenyl)phenyl]anilino)phenyl]phenyl]benzene-1,4-diamine;N-phenyl-4-(2-phenylethenyl)-N-[4-[4-(N-[4-[4-(N-[4-(2-phenylethenyl)phenyl]anilino)phenyl]phenyl]anilino)phenyl]phenyl]aniline;1-N,1-N,4-N-triphenyl-4-N-[4-[4-(N-[4-(2-phenylethenyl)phenyl]anilino)phenyl]phenyl]benzene-1,4-diamine
CID 159986160
10-[4-(9,9-dimethylfluoren-2-yl)phenyl]-5-phenylindeno[2,1-a]indene
CID 123805916

Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene?
The IUPAC name of 9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene (CID 59217045) is 9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene.
What is the SMILES notation for 9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene?
The canonical SMILES for 9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene is CC1(C)c2ccccc2-c2ccc(-c3ccc(/C=C/c4ccccc4)cc3)cc21.
What is the InChIKey of 9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene?
The InChIKey is XBDISHDQNPHLLF-OUKQBFOZSA-N. The full InChI is InChI=1S/C29H24/c1-29(2)27-11-7-6-10-25(27)26-19-18-24(20-28(26)29)23-16-14-22(15-17-23)13-12-21-8-4-3-5-9-21/h3-20H,1-2H3/b13-12+.
What are the key properties of 9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene?
9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene has a molecular weight of 372.51 g/mol, XLogP of 7.83, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-2-[4-[(E)-2-phenylethenyl]phenyl]fluorene is sourced from PubChem (CID 59217045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).