ChemicalBook--->CAS DataBase List--->7745-91-7

7745-91-7

7745-91-7 Structure

7745-91-7 Structure
IdentificationMore
[Name]

3-Bromo-4-methylaniline
[CAS]

7745-91-7
[Synonyms]

3-BROMO-4-METHYLANILINE
3-BROMO-PARA-TOLUIDINE
3-BROMO-P-TOLUIDINE
4-AMINO-2-BROMOTOLUENE
3-Bromo-1,4-toluidine
3-bromo-4-methyl-benzenamin
3-Bromo-4-methyl-phenylamine
3-bromo-p-toluidin
p-Toluidine, 3-bromo-
3-Bromo-4-methylbenzenamine
8CI.4-Amino-2-bromotolueneCh
9CI.3-Bromo-p-toluidine
3-Bromo-4-methyl-1-benzenamine
3-Bromo-4-methylbenzen-1-amine
[EINECS(EC#)]

231-807-8
[Molecular Formula]

C7H8BrN
[MDL Number]

MFCD00134176
[Molecular Weight]

186.05
[MOL File]

7745-91-7.mol
Chemical PropertiesBack Directory
[Appearance]

clear yellow to red-brown liquid after melting
[Melting point ]

27-30 °C (lit.)
[Boiling point ]

254-257 °C (lit.)
[density ]

1.4700 (rough estimate)
[refractive index ]

1.611-1.613
[Fp ]

>230 °F
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[solubility ]

DMSO, Methanol
[form ]

Liquid After Melting
[pka]

3.96±0.10(Predicted)
[color ]

Clear yellow to red-brown
[Water Solubility ]

Insoluble in water.
[BRN ]

1562057
[InChI]

1S/C7H8BrN/c1-5-2-3-6(9)4-7(5)8/h2-4H,9H2,1H3
[InChIKey]

GRXMMIBZRMKADT-UHFFFAOYSA-N
[SMILES]

Cc1ccc(N)cc1Br
[CAS DataBase Reference]

7745-91-7(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzenamine, 3-bromo-4-methyl-(7745-91-7)
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H301-H315-H319-H335
[Precautionary statements ]

P261-P264-P270-P301+P310-P302+P352-P305+P351+P338
[Hazard Codes ]

T
[Risk Statements ]

R25:Toxic if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S37/39:Wear suitable gloves and eye/face protection .
[RIDADR ]

UN 2811 6.1/PG 3
[WGK Germany ]

3
[RTECS ]

XU4375000
[Hazard Note ]

Toxic
[REACH Registrations]

Inactive
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29214300
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3-Bromo-p-toluidine(7745-91-7).msds
Hazard InformationBack Directory
[Chemical Properties]

clear yellow to red-brown liquid after melting
[Uses]

3-Bromo-4-methylaniline is used in the synthesis of 1,7-dihalo Tr?ger?s base isomers. It is suitable for use to investigate the reactions of distonic 4-(N,N,N-trimethylammonium)-2-methylphenyl and 5-(N,N,N-trimethylammonium)-2-methylphenyl radical cations with O2 by ion-trap mass spectrometry.
Spectrum DetailBack Directory
[Spectrum Detail]

3-Bromo-4-methylaniline(7745-91-7)MS
3-Bromo-4-methylaniline(7745-91-7)1HNMR
3-Bromo-4-methylaniline(7745-91-7)13CNMR
3-Bromo-4-methylaniline(7745-91-7)IR1
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Bromo-4-methylaniline, 97%(7745-91-7)
[Alfa Aesar]

3-Bromo-4-methylaniline, 97%(7745-91-7)
[Sigma Aldrich]

7745-91-7(sigmaaldrich)
[TCI AMERICA]

3-Bromo-4-methylaniline,>98.0%(GC)(T)(7745-91-7)
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