(9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene

C23H19F — CID 170544032

IUPAC(9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene
SMILESCC(C)c1ccc2c(c1)/C(=C/c1ccc(F)cc1)c1ccccc1-2
InChIInChI=1S/C23H19F/c1-15(2)17-9-12-21-19-5-3-4-6-20(19)22(23(21)14-17)13-16-7-10-18(24)11-8-16/h3-15H,1-2H3/b22-13+
InChIKeyVAYRVAFRDPZSNO-LPYMAVHISA-N
MW314.40 g/mol
LogP6.52
Rot. Bonds2

About (9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene

(9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene (PubChem CID 170544032) has the molecular formula C23H19F and a molecular weight of 314.40 g/mol. Its IUPAC name is (9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene.

Molecular Properties

Compound Name(9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene
PubChem CID170544032
Molecular FormulaC23H19F
Molecular Weight314.40 g/mol
Exact Mass314.15
IUPAC Name(9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene
SMILESCC(C)c1ccc2c(c1)/C(=C/c1ccc(F)cc1)c1ccccc1-2
InChIInChI=1S/C23H19F/c1-15(2)17-9-12-21-19-5-3-4-6-20(19)22(23(21)14-17)13-16-7-10-18(24)11-8-16/h3-15H,1-2H3/b22-13+
InChIKeyVAYRVAFRDPZSNO-LPYMAVHISA-N
XLogP6.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.40
LogP ≤ 56.52
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

(9E)-9-[(4-phenylphenyl)methylidene]-2-propan-2-ylfluorene
CID 170544030
(1Z,3Z)-1,3-bis[(4-fluorophenyl)methylidene]inden-2-one
CID 2387034
2-methyl-9-[(4-methylsulfanylphenyl)methylidene]fluorene
CID 76760087
2-[(3Z)-6-fluoro-2-methyl-3-[(4-propan-2-ylphenyl)methylidene]inden-1-yl]acetic acid
CID 46224594
1-(4-fluorophenyl)-5-propan-2-ylazulene
CID 19815703
1-fluoro-4-propan-2-ylbenzene;2-methylpropane
CID 177367696
(9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene
CID 177462584
1-fluoro-2-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene
CID 142619268
4-[(E)-[2-[3,5-bis[(9E)-9-[(4-hydroxyphenyl)methylidene]fluoren-2-yl]phenyl]fluoren-9-ylidene]methyl]phenol
CID 167227198
2-[(3Z)-6-fluoro-2-methyl-3-[[4-(4-propan-2-ylphenoxy)phenyl]methylidene]inden-1-yl]acetic acid
CID 166887755
1,2-difluoro-4-propan-2-ylbenzene;1-fluoro-4-propan-2-ylbenzene
CID 157456603
3-[(4-fluorophenyl)methylidene]-1-methylindol-2-one
CID 964242

Frequently Asked Questions

What is the IUPAC name of (9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene?
The IUPAC name of (9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene (CID 170544032) is (9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene.
What is the SMILES notation for (9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene?
The canonical SMILES for (9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene is CC(C)c1ccc2c(c1)/C(=C/c1ccc(F)cc1)c1ccccc1-2.
What is the InChIKey of (9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene?
The InChIKey is VAYRVAFRDPZSNO-LPYMAVHISA-N. The full InChI is InChI=1S/C23H19F/c1-15(2)17-9-12-21-19-5-3-4-6-20(19)22(23(21)14-17)13-16-7-10-18(24)11-8-16/h3-15H,1-2H3/b22-13+.
What are the key properties of (9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene?
(9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene has a molecular weight of 314.40 g/mol, XLogP of 6.52, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene is sourced from PubChem (CID 170544032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).