ChemicalBook--->CAS DataBase List--->5348-42-5

5348-42-5

5348-42-5 Structure

5348-42-5 Structure
IdentificationMore
[Name]

4,5-Dichloro-1,2-benzenediamine
[CAS]

5348-42-5
[Synonyms]

1,2-BENZENEDIAMINE, 4,5-DICHLORO-
1,2-DIAMINO-4,5-DICHLOROBENZENE
4,5-DICHLORO-1,2-DIAMINO BENZENE
4,5-DICHLORO-1,2-PHENYLENEDIAMINE
4,5-DICHLOROBENZENE-1,2-DIAMINE
4,5-DICHLORO-O-PHENYLENEDIAMINE
1,2-Dichloro-4,5-diaminobenzene
4,5-Dichloro-1,2-benzenediamine
4,5-Dichloro-o-phenylendiamine
4,5-Dichlorophenylene-1,2-diamine
o-Phenylenediamine, 4,5-dichloro-
Dichloroophenylenediamine
1,2-Diamino-4,5-dichlorobenzene 98%
4,5-Dichloro-1,2-phenylenediamine, 98+%
1,2-Diamino-4,5-dichlorobenzene, 4,5-Dichloro-1,2-phenylenediamine
[EINECS(EC#)]

226-305-0
[Molecular Formula]

C6H6Cl2N2
[MDL Number]

MFCD00007723
[Molecular Weight]

177.03
[MOL File]

5348-42-5.mol
Chemical PropertiesBack Directory
[Appearance]

red-brown to brown crystalline powder
[Melting point ]

158-164 °C(lit.)
[Boiling point ]

291.88°C (rough estimate)
[density ]

1.4668 (rough estimate)
[refractive index ]

1.6400 (estimate)
[storage temp. ]

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

DMSO, Methanol
[form ]

Crystalline Powder
[pka]

2.77±0.10(Predicted)
[color ]

Red-brown to brown
[Water Solubility ]

Soluble in methanol and Dimethyl sulfoxide. Insoluble in water.
[BRN ]

1072811
[InChI]

InChI=1S/C6H6Cl2N2/c7-3-1-5(9)6(10)2-4(3)8/h1-2H,9-10H2
[InChIKey]

IWFHBRFJOHTIPU-UHFFFAOYSA-N
[SMILES]

C1(N)=CC(Cl)=C(Cl)C=C1N
[CAS DataBase Reference]

5348-42-5(CAS DataBase Reference)
[NIST Chemistry Reference]

4,5-Dichloro-ortho-phenylenediamine(5348-42-5)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302+H312+H332-H315-H319-H335
[Precautionary statements ]

P261-P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338
[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 .
R40:Limited evidence of a carcinogenic effect.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37:Wear suitable protective clothing and gloves .
[RIDADR ]

2811
[WGK Germany ]

3
[F ]

10
[Hazard Note ]

Irritant
[HazardClass ]

6.1
[HS Code ]

29215900
[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
[Raw materials]

Ethanol-->Nitric acid-->FUMING SULFURIC ACID-->Nickel-->1,2-Dichlorobenzene
[Preparation Products]

Ethyl 6,7-Dichloro-3,4-dihydro-3-oxo-2-quinoxalinecarboxylate -->6,7-DICHLORO-QUINOXALIN-2-YLAMINE
Hazard InformationBack Directory
[Chemical Properties]

red-brown to brown crystalline powder
[Uses]

It is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff.
[Purification Methods]

Reflux the amine with activated charcoal in CH2Cl2, followed by recrystallisation from Et2O/pet ether or pet ether [Koolar & Kochi J Org Chem 52 4545 1987]. Alternatively, recrystallise the diamine from hexane, *C6H6, pet ether or H2O (Na2SO4) and sublime it at 150o/15mm. [Beilstein 13 IV 72.]
Spectrum DetailBack Directory
[Spectrum Detail]

4,5-Dichloro-1,2-benzenediamine(5348-42-5)1HNMR
4,5-Dichloro-1,2-benzenediamine(5348-42-5)13CNMR
4,5-Dichloro-1,2-benzenediamine(5348-42-5)IR1
4,5-Dichloro-1,2-benzenediamine(5348-42-5)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4,5-Dichloro-o-phenylenediamine, 98%(5348-42-5)
[Alfa Aesar]

4,5-Dichloro-1,2-phenylenediamine, 98%(5348-42-5)
[Sigma Aldrich]

5348-42-5(sigmaaldrich)
[TCI AMERICA]

4,5-Dichloro-1,2-phenylenediamine,>96.0%(T)(5348-42-5)
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