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ChemicalBook--->CAS DataBase List--->89-60-1

89-60-1

89-60-1 Structure

89-60-1 Structure
IdentificationMore
[Name]

4-Chloro-3-nitrotoluene
[CAS]

89-60-1
[Synonyms]

1-CHLORO-4-METHYL-2-NITROBENZENE
2-CHLORO-5-METHYLNITROBENZENE
3-NITRO-4-CHLORO TOLUENE
4-CHLORO-3-NITROTOLUENE
M-NITRO-P-CHLOROTOLUENE
1-chloro-4-methyl-2-nitro-benzen
4,3-Chloronitrotoluene
Toluene, 4-chloro-3-nitro-
toluene,4-chloro-3-nitro-
4-CHLORO-3-NITROTOLUENE, TECH
4-Chloro-3-nitrotoluene 97%
4-Chloro-3-nitrotoluene, 97+%
1-Chloro-2-nitro-4-methylbenzene
2-Chloro-5-methyl-1-nitrobenzene
4-Chloro-3-nitro-1-methylbenzene
[EINECS(EC#)]

201-922-8
[Molecular Formula]

C7H6ClNO2
[MDL Number]

MFCD00007085
[Molecular Weight]

171.58
[MOL File]

89-60-1.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR YELLOW LIQUID
[Melting point ]

7 °C(lit.)
[Boiling point ]

260 °C745 mm Hg(lit.)
[density ]

1.297 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.558(lit.)
[Fp ]

>230 °F
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

clear liquid
[color ]

Light yellow to Yellow to Orange
[BRN ]

511055
[InChIKey]

NWESJZZPAJGHRZ-UHFFFAOYSA-N
[CAS DataBase Reference]

89-60-1(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzene, 1-chloro-4-methyl-2-nitro-(89-60-1)
[EPA Substance Registry System]

89-60-1(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xn,N
[Risk Statements ]

R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R52/53:Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
[Safety Statements ]

S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
[RIDADR ]

UN 2433 6.1/PG 3
[WGK Germany ]

3
[TSCA ]

Yes
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29049085
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Copper(I) chloride-->3-Nitrotoluene
[Preparation Products]

2-Methoxy-5-methylaniline-->2-Amino-4-methylbenzonitrile-->Meclofenamic acid-->Phenol, 5-chloro-2-methyl-, acetate-->2-Chloro-5-nitrotoluene-->4-METHYL-2-NITROBENZOIC ACID-->2-Nitro-p-cresol-->4-Chloro-2-nitrotoluene
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

4-Chloro-3-nitrotoluene(89-60-1).msds
Hazard InformationBack Directory
[Chemical Properties]

CLEAR YELLOW LIQUID
[Uses]

4-Chloro-3-nitrotoluene was used in the synthesis of 4-(2-hydroxyethylamino)-3-nitrotoluene.
[Uses]

4-Chloro-3-nitrotoluene is used in the synthesis of quinazoline-2,4(1H,3H)-dione derivatives as PARP-2 selective inhibitors.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 42, p. 2426, 1977 DOI: 10.1021/jo00434a017
[General Description]

Vibrational spectral analysis of 4-chloro-3-nitrotoluene has been studied using Raman and IR spectroscopy.
Spectrum DetailBack Directory
[Spectrum Detail]

4-Chloro-3-nitrotoluene(89-60-1)MS
4-Chloro-3-nitrotoluene(89-60-1)1HNMR
4-Chloro-3-nitrotoluene(89-60-1)13CNMR
4-Chloro-3-nitrotoluene(89-60-1)IR1
4-Chloro-3-nitrotoluene(89-60-1)Raman
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

4-Chloro-3-nitrotoluene, 97+%(89-60-1)
[Sigma Aldrich]

89-60-1(sigmaaldrich)
[TCI AMERICA]

4-Chloro-3-nitrotoluene,>97.0%(GC)(89-60-1)
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