1-bromo-4-(1-fluoro-2-phenylethenyl)benzene

C14H10BrF — CID 154707764

IUPAC1-bromo-4-(1-fluoro-2-phenylethenyl)benzene
SMILESFC(=Cc1ccccc1)c1ccc(Br)cc1
InChIInChI=1S/C14H10BrF/c15-13-8-6-12(7-9-13)14(16)10-11-4-2-1-3-5-11/h1-10H
InChIKeyODIKRWDNFVDJKX-UHFFFAOYSA-N
MW277.14 g/mol
LogP4.92
Rot. Bonds2

About 1-bromo-4-(1-fluoro-2-phenylethenyl)benzene

1-bromo-4-(1-fluoro-2-phenylethenyl)benzene (PubChem CID 154707764) has the molecular formula C14H10BrF and a molecular weight of 277.14 g/mol. Its IUPAC name is 1-bromo-4-(1-fluoro-2-phenylethenyl)benzene.

Molecular Properties

Compound Name1-bromo-4-(1-fluoro-2-phenylethenyl)benzene
PubChem CID154707764
Molecular FormulaC14H10BrF
Molecular Weight277.14 g/mol
Exact Mass275.99
IUPAC Name1-bromo-4-(1-fluoro-2-phenylethenyl)benzene
SMILESFC(=Cc1ccccc1)c1ccc(Br)cc1
InChIInChI=1S/C14H10BrF/c15-13-8-6-12(7-9-13)14(16)10-11-4-2-1-3-5-11/h1-10H
InChIKeyODIKRWDNFVDJKX-UHFFFAOYSA-N
XLogP4.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.14
LogP ≤ 54.92
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

(2Z)-2-benzylidene-1-(4-bromophenyl)-4,4,4-trifluorobutane-1,3-dione
CID 126363906
(2E,4Z)-4-bromo-1-(4-bromophenyl)-5-phenylpenta-2,4-dien-1-one
CID 2046768
3-[(Z)-2-fluoro-2-phenylethenyl]pyridine
CID 141385895
4-[(Z)-2-fluoro-2-phenylethenyl]benzonitrile
CID 141385904
[2-fluoro-2-(1-fluoro-2-phenylethenyl)sulfanylethenyl]benzene
CID 66730141
2,2-difluoroethenylbenzene;1,1-difluoroprop-1-ene
CID 90783714
[(E)-2-fluoro-2-iodoethenyl]benzene
CID 11492511
1-bromo-4-[(E)-2-bromo-1-phenylethenyl]benzene
CID 44719904
1-bromo-4-[(1Z,6Z)-7-(4-bromophenyl)-2,6-diphenylhepta-1,6-dienyl]benzene
CID 101013816
CID 11750295
CID 11750295
1-bromo-4-[(Z)-1-phenylprop-1-enyl]benzene
CID 71096941
2-bromo-3-[(Z)-2-fluoro-2-phenylethenyl]pyridine
CID 134967930

Frequently Asked Questions

What is the IUPAC name of 1-bromo-4-(1-fluoro-2-phenylethenyl)benzene?
The IUPAC name of 1-bromo-4-(1-fluoro-2-phenylethenyl)benzene (CID 154707764) is 1-bromo-4-(1-fluoro-2-phenylethenyl)benzene.
What is the SMILES notation for 1-bromo-4-(1-fluoro-2-phenylethenyl)benzene?
The canonical SMILES for 1-bromo-4-(1-fluoro-2-phenylethenyl)benzene is FC(=Cc1ccccc1)c1ccc(Br)cc1.
What is the InChIKey of 1-bromo-4-(1-fluoro-2-phenylethenyl)benzene?
The InChIKey is ODIKRWDNFVDJKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrF/c15-13-8-6-12(7-9-13)14(16)10-11-4-2-1-3-5-11/h1-10H.
What are the key properties of 1-bromo-4-(1-fluoro-2-phenylethenyl)benzene?
1-bromo-4-(1-fluoro-2-phenylethenyl)benzene has a molecular weight of 277.14 g/mol, XLogP of 4.92, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-4-(1-fluoro-2-phenylethenyl)benzene is sourced from PubChem (CID 154707764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).