(9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene

C21H14F2 — CID 177462584

IUPAC(9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene
SMILESCc1ccc(/C=C2/c3ccccc3-c3cc(F)cc(F)c32)cc1
InChIInChI=1S/C21H14F2/c1-13-6-8-14(9-7-13)10-18-16-4-2-3-5-17(16)19-11-15(22)12-20(23)21(18)19/h2-12H,1H3/b18-10-
InChIKeyDXLGMJBUDIQEOE-ZDLGFXPLSA-N
MW304.34 g/mol
LogP5.84
Rot. Bonds1

About (9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene

(9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene (PubChem CID 177462584) has the molecular formula C21H14F2 and a molecular weight of 304.34 g/mol. Its IUPAC name is (9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene.

Molecular Properties

Compound Name(9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene
PubChem CID177462584
Molecular FormulaC21H14F2
Molecular Weight304.34 g/mol
Exact Mass304.11
IUPAC Name(9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene
SMILESCc1ccc(/C=C2/c3ccccc3-c3cc(F)cc(F)c32)cc1
InChIInChI=1S/C21H14F2/c1-13-6-8-14(9-7-13)10-18-16-4-2-3-5-17(16)19-11-15(22)12-20(23)21(18)19/h2-12H,1H3/b18-10-
InChIKeyDXLGMJBUDIQEOE-ZDLGFXPLSA-N
XLogP5.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.34
LogP ≤ 55.84
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

2-methyl-9-[(4-methylsulfanylphenyl)methylidene]fluorene
CID 76760087
(1E)-3-ethyl-5-fluoro-2-methyl-1-[(4-methylphenyl)methylidene]indene
CID 90131086
(9E)-9-[(4-fluorophenyl)methylidene]-2-propan-2-ylfluorene
CID 170544032
(1Z,3Z)-1,3-bis[(4-fluorophenyl)methylidene]inden-2-one
CID 2387034
ethane;1-ethyl-2-methyl-3-[(4-methylphenyl)methylidene]indene
CID 91066006
2-[(3Z)-4,6-difluoro-2-methyl-3-[(4-methylsulfanylphenyl)methylidene]inden-1-yl]propanoic acid
CID 70151015
1,2,4-trifluoro-3-[2-(2,3,5-trifluorophenyl)phenyl]benzene
CID 161120611
9-benzylidene-2,7-dimethylfluorene;ethane
CID 91037957
2-[(3E)-6-fluoro-2-methyl-3-[(4-methylphenyl)methylidene]inden-1-yl]acetic acid
CID 59167151
4-[(E)-[2-[3,5-bis[(9E)-9-[(4-hydroxyphenyl)methylidene]fluoren-2-yl]phenyl]fluoren-9-ylidene]methyl]phenol
CID 167227198
(3E)-3-[(4-methylphenyl)methylidene]-1H-indole-2-thione
CID 54671621
1-fluoro-2-[2-(4-methylphenyl)phenyl]benzene
CID 139250939

Frequently Asked Questions

What is the IUPAC name of (9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene?
The IUPAC name of (9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene (CID 177462584) is (9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene.
What is the SMILES notation for (9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene?
The canonical SMILES for (9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene is Cc1ccc(/C=C2/c3ccccc3-c3cc(F)cc(F)c32)cc1.
What is the InChIKey of (9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene?
The InChIKey is DXLGMJBUDIQEOE-ZDLGFXPLSA-N. The full InChI is InChI=1S/C21H14F2/c1-13-6-8-14(9-7-13)10-18-16-4-2-3-5-17(16)19-11-15(22)12-20(23)21(18)19/h2-12H,1H3/b18-10-.
What are the key properties of (9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene?
(9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene has a molecular weight of 304.34 g/mol, XLogP of 5.84, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (9Z)-1,3-difluoro-9-[(4-methylphenyl)methylidene]fluorene is sourced from PubChem (CID 177462584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).