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ChemicalBook--->CAS DataBase List--->1122-91-4

1122-91-4

1122-91-4 Structure

1122-91-4 Structure
IdentificationMore
[Name]

4-Bromobenzaldehyde
[CAS]

1122-91-4
[Synonyms]

4-BBA
4-BROMOBENZALDEHYDE
4-BROMOBENZYLALDEHYDE
AKOS BBS-00003194
LABOTEST-BB LT00929178
P-BROMOBENZALDEHYDE
4-Brombenzaldehyd
4-bromo-benzaldehyd
Benzaldehyde, p-bromo-
Benzaldehyde,4-bromo-
p-bromo-benzaldehyd
p-Bromobenzaldehyde 4-Bromobenzaldehyde
Bromobenzaldehyde
4-Bromobenzaldehyde99%
4-BROMO BENZALDEHYDE FOR SYNTHESIS
Ethyl 2-bromoisopentanoate
1-Bromo-4-formylbenzene
4-Formylbromobenzene
[EINECS(EC#)]

214-365-0
[Molecular Formula]

C7H5BrO
[MDL Number]

MFCD00003377
[Molecular Weight]

185.02
[MOL File]

1122-91-4.mol
Chemical PropertiesBack Directory
[Appearance]

white crystalline solid
[Melting point ]

55-58 °C(lit.)
[Boiling point ]

66-68°C 2mm
[bulk density]

670kg/m3
[density ]

1.85 g/cm3
[refractive index ]

1.5727 (estimate)
[Fp ]

228 °F
[storage temp. ]

Store below +30°C.
[solubility ]

Chloroform, Ethyl Acetate
[form ]

Crystalline Solid
[color ]

White
[Water Solubility ]

INSOLUBLE
[Sensitive ]

Air Sensitive
[Detection Methods]

GC
[BRN ]

507100
[InChIKey]

ZRYZBQLXDKPBDU-UHFFFAOYSA-N
[LogP]

2.75 at 25℃
[CAS DataBase Reference]

1122-91-4(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzaldehyde, 4-bromo-(1122-91-4)
[Storage Precautions]

Moisture sensitive;Store under nitrogen;Light sensitive
[EPA Substance Registry System]

1122-91-4(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
R43:May cause sensitization by skin contact.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37:Wear suitable protective clothing and gloves .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S22:Do not breathe dust .
[RIDADR ]

2811
[WGK Germany ]

2
[RTECS ]

CU4810000
[Hazard Note ]

Irritant/Harmful/Air Sensitive
[TSCA ]

Yes
[HazardClass ]

6.1(b)
[PackingGroup ]

III
[HS Code ]

29130000
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Calcium carbonate-->4-Bromotoluene-->Methanediol, 1-(4-bromophenyl)-, 1,1-diacetate-->4-BROMOBENZALDEHYDE PHENYLHYDRAZONE
[Preparation Products]

1-(4-Morpholinobutyl)hydrazine-->1-(4-(Pyrrolidin-1-yl)butyl)hydrazine-->6-Bromoisoquinoline-->1-(3-(pyrrolidin-1-yl)propyl)hydrazine-->6-BROMO-1H-INDOLE-2-CARBALDEHYDE-->(6-BROMO-1H-INDOL-2-YL)METHANOL-->6-Bromoindole-2-carboxylic acid-->Ethyl 6-bromoindole-2-carboxylate-->2-Hydrazinopyridine-->4-Hex-1-ynylbenzaldehyde-->3-HYDRAZINOPYRIDINE Dihydrochloride-->4-(3-THIENYL)BENZALDEHYDE-->4-Formylphenylboronic acid-->4-(Hydroxymethyl)phenylboronic acid-->2-HYDRAZINO-6-METHYLPYRIMIDIN-4-OL-->1,3,5-Tris(p-formylphenyl)benzene-->1-(4-Bromophenyl)hexane-->4-Bromobenzylamine-->4-Bromobenzyl alcohol
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

4-Bromobenzaldehyde(1122-91-4).msds
Hazard InformationBack Directory
[Chemical Properties]

white crystalline solid
[Uses]

4-Bromobenzaldehyde is widely utilized as an intermediate for the preparation of agrochemicals, pharmaceuticals and other organic compounds. It is used as a precursor and reacts with sulfamethoxazole to prepare Schiff?s base, 4-[(4-Bromo-benzylidene)-amino]-N-(5-methyl-isoxazol-3-yl)-benzene sulfonamide, which can be used for the photo stability of polyvinyl chloride (PVC). It plays an important role in palladium-catalyzed mono- and bis-arylation of 3,4-(ethylenedioxy)thiophenes. It is employed in a cross-coupling study with potassium vinyltrifluoroborate.
[Reactions]

4-Bromobenzaldehyde is widely utilized as an intermediate for preparing agrochemicals, pharmaceuticals, and other organic compounds. It is used as a precursor and reacts with sulfamethoxazole to prepare Schiff?s base, 4-[(4-Bromo-benzylidene)-amino]-N-(5-methyl-isoxazol-3-yl)-benzene sulfonamide, which can be used for the photostability of polyvinyl chloride (PVC). It plays a vital role in palladium-catalyzed mono- and bis-arylation of 3,4-(ethylenedioxy)thiophenes. It is employed in a cross-coupling study with potassium vinyltrifluoroborate.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 81, p. 4113, 1959 DOI: 10.1021/ja01524a080
Tetrahedron Letters, 21, p. 813, 1980 DOI: 10.1016/S0040-4039(00)71512-7
[Preparation]

4-Bromobenzaldehyde is prepared by 2-Iodoxy-5-Methylbenzenesulfonic Acid-Catalyzed Selective Oxidation of 4-Bromobenzyl Alcohol.
Spectrum DetailBack Directory
[Spectrum Detail]

4-Bromobenzaldehyde(1122-91-4)MS
4-Bromobenzaldehyde(1122-91-4)1HNMR
4-Bromobenzaldehyde(1122-91-4)13CNMR
4-Bromobenzaldehyde(1122-91-4)IR1
4-Bromobenzaldehyde(1122-91-4)IR2
4-Bromobenzaldehyde(1122-91-4)IR3
4-Bromobenzaldehyde(1122-91-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-Bromobenzaldehyde, 99%(1122-91-4)
[Alfa Aesar]

4-Bromobenzaldehyde, 99%(1122-91-4)
[Sigma Aldrich]

1122-91-4(sigmaaldrich)
[TCI AMERICA]

4-Bromobenzaldehyde,>95.0%(GC)(1122-91-4)
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