2-Chloro-4-nitrotoluene

C₇H₆ClNO₂CAS 121-86-8171.58 g/mol

Open in Covalent MOL file

Aryl halide Nitro

Properties

Molecular formula: C₇H₆ClNO₂
Molar mass: 171.58 g/mol
Exact mass: 171.0087 Da
Melting point: 68 °C
Boiling point: 260 °C
logP: 2.56Crippen estimate
Polar surface area: 43.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Identifiers

CAS number

121-86-8

SMILES

Cc1ccc([N+](=O)[O-])cc1Cl

InChIKey

LLYXJBROWQDVMI-UHFFFAOYSA-N

InChI

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

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

11 names

Benzene, 2-chloro-1-methyl-4-nitro-
Toluene, 2-chloro-4-nitro-
2-Chloro-1-methyl-4-nitrobenzene
3-Chloro-4-methylnitrobenzene
2-Chloro-4-nitro-1-methylbenzene
1-Chloro-2-methyl-5-nitrobenzene
4-Nitro-2-chlorotoluene
2-Chloro-4-nitrophenylmethane
NSC 60111
3-Chloro-4-methyl-1-nitrobenzene
1-Methyl-2-chloro-4-nitrobenzene

Work with 2-Chloro-4-nitrotoluene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Same formula

4-Nitrobenzyl chloride100-14-1 1-Chloro-2-methyl-4-nitrobenzene13290-74-9 2-Amino-6-chlorobenzoic acid2148-56-3 3-Amino-5-chlorobenzoic acid21961-30-8 4-Amino-2-chlorobenzoic acid2457-76-3 4-Amino-3-chlorobenzoic acid2486-71-7 3-Amino-4-chlorobenzoic acid2840-28-0 2-Chloro-6-methylnicotinic acid30529-70-5

Elsewhere

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