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90-90-4

90-90-4 Structure

90-90-4 Structure
IdentificationMore
[Name]

4-BROMOBENZOPHENONE
[CAS]

90-90-4
[Synonyms]

4-BROMOBENZOPHENONE
LABOTEST-BB LT00053402
P-BROMOBENZOPHENONE
(4-Bromophenyl)(phenyl)methanone
(4-bromophenyl)phenyl-methanon
4-bromo-benzophenon
4-bromophenylphenylketone
Benzophenone, 4-bromo-
p-benzoylbromobenzene
USAF do-3
4-Bromobenzophenone,98%
p-BROMOBENZOPHENONE pure
Phenyl-4-Bromophenyl Ketone
p-Bromodiphenyl Ketone
[EINECS(EC#)]

202-024-9
[Molecular Formula]

C13H9BrO
[MDL Number]

MFCD00000103
[Molecular Weight]

261.11
[MOL File]

90-90-4.mol
Chemical PropertiesBack Directory
[Appearance]

WHITE TO LIGHT BEIGE CRYSTALLINE POWDER
[Melting point ]

79-84 °C(lit.)
[Boiling point ]

350 °C(lit.)
[density ]

1.4245 (rough estimate)
[refractive index ]

1.5130 (estimate)
[Fp ]

350°C
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

Crystalline Powder
[color ]

White to light beige
[Water Solubility ]

Insoluble in water but slightly soluble in other solvents such as ethanol, ether and benzene.
[BRN ]

1910182
[InChI]

InChI=1S/C13H9BrO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9H
[InChIKey]

KEOLYBMGRQYQTN-UHFFFAOYSA-N
[SMILES]

C(C1=CC=C(Br)C=C1)(C1=CC=CC=C1)=O
[CAS DataBase Reference]

90-90-4(CAS DataBase Reference)
[EPA Substance Registry System]

4-Bromobenzophenone (90-90-4)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

3
[RTECS ]

DJ0350000
[HS Code ]

29147000
Hazard InformationBack Directory
[Chemical Properties]

WHITE TO LIGHT BEIGE CRYSTALLINE POWDER
[Uses]

4-Bromobenzophenone is used in analytical applications such as HPLC and GC. It is also used as a chemical reagent and pharmaceutical intermediate.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 31, p. 2708, 1966 DOI: 10.1021/jo01346a526
Tetrahedron Letters, 27, p. 929, 1986 DOI: 10.1016/S0040-4039(00)84140-4
[Purification Methods]

Crystallise the phenone from EtOH. The 2,4-dinitrophenylhydrazone forms orange-red leaflets from dioxane/EtOH with m 207-209o. [Allen & Van Allan J Am Chem Soc 66 7 1944, Beilstein 7 H 422, 7 III 2079, 7 IV 1378.]
Spectrum DetailBack Directory
[Spectrum Detail]

4-BROMOBENZOPHENONE(90-90-4)MS
4-BROMOBENZOPHENONE(90-90-4)1HNMR
4-BROMOBENZOPHENONE(90-90-4)13CNMR
4-BROMOBENZOPHENONE(90-90-4)IR1
4-BROMOBENZOPHENONE(90-90-4)IR2
4-BROMOBENZOPHENONE(90-90-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Bromobenzophenone, 97%(90-90-4)
[Alfa Aesar]

4-Bromobenzophenone, 98%(90-90-4)
[Sigma Aldrich]

90-90-4(sigmaaldrich)
[TCI AMERICA]

4-Bromobenzophenone,>98.0%(GC)(90-90-4)
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