ChemicalBook--->CAS DataBase List--->17601-94-4

17601-94-4

17601-94-4 Structure

17601-94-4 Structure
IdentificationMore
[Name]

2-Amino-3-bromo-5-nitrobenzonitrile
[CAS]

17601-94-4
[Synonyms]

2-AMINO-3-BROMO-5-NITROBENZONITRILE
6-BROMO-2-CYANO-4-NITROANILINE
2-amino-3-bromo-5-nitro-benzonitril
2-Cyan-4-nitro-6-bromoaniline
2-Cyano-4-nitro-6-bromoaniline
6-Bromo-2-Cyano-4-Nitroaniline 2-Cyano-4-Nitro-6-Bromoaniline
2-Bromo-6-cyano-4-nitroaniline
Benzonitrile, 2-amino-3-bromo-5-nitro-
6-Bromo-4-nitro-2-cyanoaniline
[EINECS(EC#)]

241-574-4
[Molecular Formula]

C7H4BrN3O2
[MDL Number]

MFCD00054185
[Molecular Weight]

242.03
[MOL File]

17601-94-4.mol
Chemical PropertiesBack Directory
[Appearance]

yellow powder
[Melting point ]

180-185 °C(lit.)
[Boiling point ]

374.8±42.0 °C(Predicted)
[density ]

1.8856 (rough estimate)
[refractive index ]

1.6200 (estimate)
[storage temp. ]

2-8°C, protect from light
[form ]

powder to crystal
[pka]

-4.23±0.20(Predicted)
[color ]

Light orange to Yellow to Green
[InChI]

1S/C7H4BrN3O2/c8-6-2-5(11(12)13)1-4(3-9)7(6)10/h1-2H,10H2
[InChIKey]

MUHLVSZIVTURCZ-UHFFFAOYSA-N
[SMILES]

Nc1c(Br)cc(cc1C#N)[N+]([O-])=O
[CAS DataBase Reference]

17601-94-4(CAS DataBase Reference)
[EPA Substance Registry System]

17601-94-4(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and 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 .
S36/39:Wear suitable protective clothing and eye/face protection .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[TSCA ]

Yes
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29269090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

Disperse Blue SE-2R-->Disperse Blue 257-->Disperse Blue 201-->Disperse Blue 211-->Disperse Blue 183-->C.I.Disperse Blue 128
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2-Amino-3-bromo-5-nitrobenzonitrile(17601-94-4).msds
Questions And AnswerBack Directory
[Application]

2-Cyano-4-nitro-6-bromoaniline is an important intermediate for disperse dyes and a crucial raw material for the synthesis of disperse dyes such as Disperse Blue 183.
Hazard InformationBack Directory
[Chemical Properties]

yellow powder
Spectrum DetailBack Directory
[Spectrum Detail]

2-Amino-3-bromo-5-nitrobenzonitrile(17601-94-4)1HNMR
2-Amino-3-bromo-5-nitrobenzonitrile(17601-94-4)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Amino-3-bromo-5-nitrobenzonitrile, 98%(17601-94-4)
[Alfa Aesar]

2-Amino-3-bromo-5-nitrobenzonitrile, 98%(17601-94-4)
[Sigma Aldrich]

17601-94-4(sigmaaldrich)
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