Catalog No.:AA003WRR

89-60-1 | 4-Chloro-3-nitrotoluene

Name: Name:4-Chloro-3-nitrotoluene
Brand: AABLOCKS
SKU: AA003WRR
Availability: InStock
Rating: 90 (10 reviews)

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10g

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in stock

$7.00 $5.00

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25g

98%

in stock

$9.00 $7.00

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500g

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in stock

$172.00 $121.00

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Technical Information
Properties
Upstream Synthesis Route
Downstream Synthesis Route
Literature
Request for Quotation
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Technical Information
Properties
Upstream Synthesis Route
Downstream Synthesis Route
Literature

Technical Information

Catalog Number:

AA003WRR

Chemical Name:

4-Chloro-3-nitrotoluene

CAS Number:

89-60-1

Molecular Formula:

C7H6ClNO2

Molecular Weight:

171.5810

MDL Number:

MFCD00007085

SMILES:

Cc1ccc(c(c1)[N+](=O)[O-])Cl

NSC Number:

60721

Properties

BP:

261.0°C

Form:

Liquid

MP:

7 °C

Refractive Index:

n20/D 1.558(lit.)

Storage:

Keep in dry area;Room Temperature;

Computed Properties

Complexity:

157

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

XLogP3:

2.8

Upstream Synthesis Route

27329-27-7

89-60-1

[1]Patent:CN107325002,2017,A,.Locationinpatent:Paragraph0091

[2]OrganicandBiomolecularChemistry,2018,vol.16,#30,p.5416-5421

[3]JournalofOrganicChemistry,2016,vol.81,#7,p.2794-2803

89-62-3

89-60-1

[1]OrganicProcessResearchandDevelopment,2017,vol.21,#1,p.44-51

[2]JournaloftheSocietyofDyersandColourists,vol.41,p.329

[3]Chem.Zentralbl.,1926,vol.97,#II,p.1526

[4]ChemischeBerichte,1885,vol.18,p.2603

[5]JournalofOrganicChemistry,1977,vol.42,p.2426-2431

[6]ActaChemicaScandinavica,SeriesB:OrganicChemistryandBiochemistry,1976,vol.30,p.141-149

[7]Patent:US2007/27178,2007,A1,.Locationinpatent:Page/Pagecolumn22

106-43-4

89-59-8

89-60-1

[1]JournaloftheChemicalSociety-PerkinTransactions1,1996,#19,p.2385-2389

[2]JournaloftheIndianChemicalSociety,1988,vol.65,p.415-416

[3]JournaloftheIndianChemicalSociety,1988,vol.65,p.415-416

[4]JournaloftheSocietyofDyersandColourists,vol.41,p.329

[5]Chem.Zentralbl.,1926,vol.97,#II,p.1526

[6]JournaloftheChemicalSociety,1924,vol.125,p.2195

[7]ChemischeBerichte,1886,vol.19,p.2443

[8]ChemischeBerichte,1887,vol.20,p.199

[9]ChemischeBerichte,1874,vol.7,p.797

[10]ChemischeBerichte,1886,vol.19,p.2443

[11]ChemischeBerichte,1887,vol.20,p.199

[12]ChemischeBerichte,1874,vol.7,p.797

106-43-4

119-33-5

89-59-8

89-60-1

[1]JournaloftheChemicalSociety,PerkinTransactions2:PhysicalOrganicChemistry(1972-1999),1983,#11,p.1793-1802

[2]JournaloftheChemicalSociety,PerkinTransactions2:PhysicalOrganicChemistry(1972-1999),1983,#11,p.1793-1802

106-43-4

89-60-1

[1]HelveticaChimicaActa,1929,vol.12,p.932

[2]JournaloftheSocietyofDyersandColourists,vol.41,p.329

[3]Chem.Zentralbl.,1926,vol.97,#II,p.1526

[4]JournaloftheChemicalSociety,1924,vol.125,p.2195

[5]JournaloftheChemicalSociety,PerkinTransactions2:PhysicalOrganicChemistry(1972-1999),1983,#11,p.1793-1802

[6]JournaloftheChemicalSociety,PerkinTransactions2:PhysicalOrganicChemistry(1972-1999),1983,#11,p.1793-1802

Downstream Synthesis Route

106-43-4

89-59-8

89-60-1

[1]JournaloftheChemicalSociety.PerkintransactionsI,1996,p.2385-2389

[2]JournaloftheIndianChemicalSociety,1988,vol.65,p.415-416

[3]JournaloftheIndianChemicalSociety,1988,vol.65,p.415-416

[4]JournaloftheSocietyofDyersandColourists,vol.41,p.329 ChemischesZentralblatt,1926,vol.97,p.1526

[5]ChemischeBerichte,1886,vol.19,p.2443 ChemischeBerichte,1887,vol.20,p.199

[6]ChemischeBerichte,1886,vol.19,p.2443 ChemischeBerichte,1887,vol.20,p.199

67-56-1

89-60-1

119-10-8

[1]HelveticaChimicaActa,1929,vol.12,p.932

6819-41-6

89-60-1

95-81-8

<i>N</i>-(2-chloro-5-methyl-phenyl)-alanine

[1]JournaloftheAmericanChemicalSociety,1931,vol.53,p.2357,2361

930-69-8

89-60-1

33358-35-9

[1]Patent:WO2008/133753,2008,A2.Locationinpatent:Page/Pagecolumn56-57

[2]JournaloftheChemicalSociety,1959,p.885,887

6819-41-6

89-60-1

71-43-2

95-81-8

<i>N</i>-(2-chloro-5-methyl-phenyl)-alanine

[1]JournaloftheAmericanChemicalSociety,1931,vol.53,p.2357,2361

Literature

Title: FT-IR, FT-Raman, ab initio, HF and DFT studies, NBO, HOMO-LUMO and electronic structure calculations on 4-chloro-3-nitrotoluene.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120401

Title: Vibrational analysis of mononitro substituted benzamides, benzaldehydes and toluenes. Part II. Transferability of valence force constants.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20040101

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