9-[bis(3-bromophenyl)methylidene]fluorene

C26H16Br2 — CID 11518766

IUPAC9-[bis(3-bromophenyl)methylidene]fluorene
SMILESBrc1cccc(C(=C2c3ccccc3-c3ccccc32)c2cccc(Br)c2)c1
InChIInChI=1S/C26H16Br2/c27-19-9-5-7-17(15-19)25(18-8-6-10-20(28)16-18)26-23-13-3-1-11-21(23)22-12-2-4-14-24(22)26/h1-16H
InChIKeyHVWBSZRIKOYZSC-UHFFFAOYSA-N
MW488.22 g/mol
LogP8.20
Rot. Bonds2

About 9-[bis(3-bromophenyl)methylidene]fluorene

9-[bis(3-bromophenyl)methylidene]fluorene (PubChem CID 11518766) has the molecular formula C26H16Br2 and a molecular weight of 488.22 g/mol. Its IUPAC name is 9-[bis(3-bromophenyl)methylidene]fluorene.

Molecular Properties

Compound Name9-[bis(3-bromophenyl)methylidene]fluorene
PubChem CID11518766
Molecular FormulaC26H16Br2
Molecular Weight488.22 g/mol
Exact Mass485.96
IUPAC Name9-[bis(3-bromophenyl)methylidene]fluorene
SMILESBrc1cccc(C(=C2c3ccccc3-c3ccccc32)c2cccc(Br)c2)c1
InChIInChI=1S/C26H16Br2/c27-19-9-5-7-17(15-19)25(18-8-6-10-20(28)16-18)26-23-13-3-1-11-21(23)22-12-2-4-14-24(22)26/h1-16H
InChIKeyHVWBSZRIKOYZSC-UHFFFAOYSA-N
XLogP8.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500488.22
LogP ≤ 58.20
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

1-[[2,3-bis[bis(3-bromophenyl)methylidene]cyclopropylidene]-(3-bromophenyl)methyl]-3-bromobenzene
CID 15456668
1,3-dibromo(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene
CID 54590075
N-benzoyl-3-bromobenzamide
CID 118577200
1-(3-bromophenyl)butan-1-one
CID 18417701
9-[bromo-(4-bromophenyl)methylidene]fluorene
CID 86111759
3-bromobenzoic acid;ethane
CID 143530590
4-benzhydrylidene-2,3-dibromonaphthalen-1-one
CID 12963079
N'-amino-3-bromobenzenecarboximidamide
CID 83534045
1,3-dibromocyclodeca-1,3,5,7,9-pentaene
CID 144708258
1-bromo-3-(3-phenylprop-1-en-2-yl)benzene
CID 174355940
3-[(Z)-(3-bromophenyl)-indol-1-ium-3-ylidenemethyl]-1H-indole
CID 155772227
3-bromo-N-[(3-bromophenyl)-chloromethylidene]-4-methylbenzenecarbohydrazonoyl chloride
CID 123309904

Frequently Asked Questions

What is the IUPAC name of 9-[bis(3-bromophenyl)methylidene]fluorene?
The IUPAC name of 9-[bis(3-bromophenyl)methylidene]fluorene (CID 11518766) is 9-[bis(3-bromophenyl)methylidene]fluorene.
What is the SMILES notation for 9-[bis(3-bromophenyl)methylidene]fluorene?
The canonical SMILES for 9-[bis(3-bromophenyl)methylidene]fluorene is Brc1cccc(C(=C2c3ccccc3-c3ccccc32)c2cccc(Br)c2)c1.
What is the InChIKey of 9-[bis(3-bromophenyl)methylidene]fluorene?
The InChIKey is HVWBSZRIKOYZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H16Br2/c27-19-9-5-7-17(15-19)25(18-8-6-10-20(28)16-18)26-23-13-3-1-11-21(23)22-12-2-4-14-24(22)26/h1-16H.
What are the key properties of 9-[bis(3-bromophenyl)methylidene]fluorene?
9-[bis(3-bromophenyl)methylidene]fluorene has a molecular weight of 488.22 g/mol, XLogP of 8.20, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[bis(3-bromophenyl)methylidene]fluorene is sourced from PubChem (CID 11518766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).