CAS 460-00-4 4-Fluorobromobenzene - Materials / Alfa Chemistry

NAVIGATION

4-Fluorobromobenzene

PRICE INQUIRY

Catalog Number

ACM460004-2

CAS Number

460-00-4

Product Name

4-Fluorobromobenzene

Category

Liquid Crystal (LC) Building Blocks

Synonyms

1-bromo-4-fluoro-benzen;1-Fluoro-4-bromobenzene;4-Bromfluorbenzol;4-Fluorbrombenzol;4-Fluoro-1-bromobenzene;4-Fluorophenyl bromide;4-fluorophenylbromide;Benzene, 1-bromo-4-fluoro-

Description

1-bromo-4-fluorobenzene is a colorless liquid. (NTP, 1992)

IUPAC Name

1-bromo-4-fluorobenzene

Molecular Weight

175g/mol

Molecular Formula

C6H4BrF

Canonical SMILES

C1=CC(=CC=C1F)Br

InChI

InChI=1S/C6H4BrF/c7-5-1-3-6(8)4-2-5/h1-4H

InChI Key

AITNMTXHTIIIBB-UHFFFAOYSA-N

Boiling Point

306 °F at 764 mm Hg (NTP, 1992);151.5 °C

Melting Point

18 °F (NTP, 1992);-17.4 °C

Flash Point

140 °F (NTP, 1992)

Density

1.4946 at 68 °F (NTP, 1992)

Application

4-Fluorobromobenzene is a versatile, clear, colorless liquid intended to serve as a surrogate standard in various analytical applications. It is particularly useful in assessing the toxicity of diesel and water accommodated diesel fractions (WAF) on microalgal species such as Pseudokirchneriella subcapitata and Chlorella sp. MM3. This is achieved using gas chromatography coupled with mass spectrometry (GC-MS). Additionally, 4-Fluorobromobenzene facilitates the determination of chemicals like benzene, toluene, ethylbenzene, and xylene (BTEX), as well as their stable carbon isotopic values, in gasoline-contaminated groundwater, leveraging the precision of GC-MS. As a member of the bromobenzenes, with a fluoro atom at the 4th position, it belongs to both the bromobenzenes and monofluorobenzenes classes.

Complexity

66.9

Covalently-Bonded Unit Count

EC Number

207-300-2

Exact Mass

173.94804g/mol

Formal Charge

Hazard Statements

Xi,F,Xn,T

Heavy Atom Count

Log P