Skip to Content
Merck
All Photos(1)

Key Documents

View All Documentation

101702

Sigma-Aldrich

4-Chloro-2-nitrotoluene

98%

Sign Into View Organizational & Contract Pricing
All Photos(1)

About This Item

Linear Formula:
CH3C6H3(NO2)Cl
CAS Number:
89-59-8
Molecular Weight:
171.58
Beilstein:
2046651
EC Number:
201-921-2
MDL number:
MFCD00007215
UNSPSC Code:
12352100
PubChem Substance ID:
24846551
NACRES:
NA.22
form:
solid
Assay:
98%
Pricing and availability is not currently available.

Quality Level

100

Assay

98%

form

solid

bp

239-240 °C/718 mmHg (lit.)

mp

34-38 °C (lit.)

functional group

chloro
nitro

SMILES string

Cc1ccc(Cl)cc1[N+]([O-])=O

InChI

1S/C7H6ClNO2/c1-5-2-3-6(8)4-7(5)9(10)11/h2-4H,1H3

InChI key

SQFLFRQWPBEDHM-UHFFFAOYSA-N

Looking for similar products? Visit Product Comparison Guide

Related Categories

Application

4-Chloro-2-nitrotoluene can be used in the synthesis of indigo dye[1].

Biochem/physiol Actions

4-Chloro-2-nitrotoluene is the starting reagent for synthesis of tricyclic indole-2-carboxylic acids, a potential NMDA-glycine antagonists[2].

Storage Class Code

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 2

Flash Point(F)

248.0 °F - closed cup

Flash Point(C)

120 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Choose from one of the most recent versions:

Certificates of Analysis (COA)

Lot/Batch Number
STBL1045
STBK3741
STBK1567
STBJ6090
STBJ5459

Don't see the Right Version?

If you require a particular version, you can look up a specific certificate by the Lot or Batch number.

Search for a COA

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Thanasis Karapanayiotis et al.
The Analyst, 129(7), 613-618 (2004-06-24)
The Raman and electron impact mass spectra of synthetic indigo and its four 6,6'-dihalogeno analogues are reported and discussed. The influence of varying the halogen on these Raman spectra is considered. Particular emphasis is laid on distinguishing indigo from 6,6'-dibromoindigo
S Katayama et al.
The Journal of organic chemistry, 66(10), 3474-3483 (2001-05-12)
The practical synthesis of a series of tricyclic indole-2-carboxylic acids, 7-chloro-3-arylaminocarbonylmethyl-1,3,4,5-tetrahydrobenz[cd]indole-2-carboxylic acids, as a new class of potent NMDA-glycine antagonists is described. The synthetic route to the key intermediate 12a comprises a regioselective iodination of 4-chloro-2-nitrotoluene, modified Reissert indole synthesis
D de Almeida Azevedo et al.
Journal of chromatography. A, 879(1), 13-26 (2000-06-28)
Gas chromatography-mass spectrometry (GC-MS) and liquid chromatography-atmospheric pressure chemical ionization mass spectrometry (LC-APCI-MS) were optimized and applied for the trace-level determination of 42 priority pesticides and 33 priority organic pollutants from European Union Directive EC 76/464. First, off-line solid-phase extraction

Questions

Reviews

No rating value

Active Filters

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service