2-(2-bromoethenyl)-1,3-difluorobenzene

C8H5BrF2 — CID 123354850

IUPAC2-(2-bromoethenyl)-1,3-difluorobenzene
SMILESFc1cccc(F)c1C=CBr
InChIInChI=1S/C8H5BrF2/c9-5-4-6-7(10)2-1-3-8(6)11/h1-5H
InChIKeyHGYOURXXPPQUBQ-UHFFFAOYSA-N
MW219.03 g/mol
LogP3.33
Rot. Bonds1

About 2-(2-bromoethenyl)-1,3-difluorobenzene

2-(2-bromoethenyl)-1,3-difluorobenzene (PubChem CID 123354850) has the molecular formula C8H5BrF2 and a molecular weight of 219.03 g/mol. Its IUPAC name is 2-(2-bromoethenyl)-1,3-difluorobenzene.

Molecular Properties

Compound Name2-(2-bromoethenyl)-1,3-difluorobenzene
PubChem CID123354850
Molecular FormulaC8H5BrF2
Molecular Weight219.03 g/mol
Exact Mass217.95
IUPAC Name2-(2-bromoethenyl)-1,3-difluorobenzene
SMILESFc1cccc(F)c1C=CBr
InChIInChI=1S/C8H5BrF2/c9-5-4-6-7(10)2-1-3-8(6)11/h1-5H
InChIKeyHGYOURXXPPQUBQ-UHFFFAOYSA-N
XLogP3.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.03
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

N-[(E)-2-(2,6-difluorophenyl)ethenyl]formamide
CID 102120376
(Z)-3-(2,6-difluorophenyl)prop-2-enal
CID 86308027
2-[(Z)-but-1-enyl]-1,3-difluorobenzene;ethane
CID 145147659
(E)-3-(2,6-difluorophenyl)prop-2-enoyl chloride
CID 11424232
(E)-4-(2,6-difluorophenyl)but-3-en-2-one
CID 18371119
(E)-4-(2,6-difluorophenyl)but-3-en-2-amine
CID 103091649
2-[(E)-2-(2,6-difluorophenyl)ethenyl]-N,N-dimethylaniline
CID 51349716
2,6-dibromo-4-[(E)-2-(2,6-difluorophenyl)ethenyl]phenol
CID 45257590
1-[(E)-2-bromoethenyl]-3-fluoro-2-(trifluoromethoxy)benzene
CID 178190874
1-chloro-3-fluoro-2-[(E)-2-phenylethenyl]benzene
CID 162694789
(E)-3-(2,6-difluorophenyl)prop-2-enimidamide
CID 131242918
1-bromo-2-(3-chloroprop-1-enyl)-3-fluorobenzene
CID 169478313

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromoethenyl)-1,3-difluorobenzene?
The IUPAC name of 2-(2-bromoethenyl)-1,3-difluorobenzene (CID 123354850) is 2-(2-bromoethenyl)-1,3-difluorobenzene.
What is the SMILES notation for 2-(2-bromoethenyl)-1,3-difluorobenzene?
The canonical SMILES for 2-(2-bromoethenyl)-1,3-difluorobenzene is Fc1cccc(F)c1C=CBr.
What is the InChIKey of 2-(2-bromoethenyl)-1,3-difluorobenzene?
The InChIKey is HGYOURXXPPQUBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5BrF2/c9-5-4-6-7(10)2-1-3-8(6)11/h1-5H.
What are the key properties of 2-(2-bromoethenyl)-1,3-difluorobenzene?
2-(2-bromoethenyl)-1,3-difluorobenzene has a molecular weight of 219.03 g/mol, XLogP of 3.33, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromoethenyl)-1,3-difluorobenzene is sourced from PubChem (CID 123354850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).