4-Methoxy-2-methyl-6-nitroaniline

C₈H₁₀N₂O₃CAS 684237-54-5182.18 g/mol

Open in Covalent MOL file

Ether Nitro Primary amine

Properties

Molecular formula: C₈H₁₀N₂O₃
Molar mass: 182.18 g/mol
Exact mass: 182.0691 Da
logP: 1.49Crippen estimate
Polar surface area: 78.4 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

684237-54-5

SMILES

CC1=CC(=CC(=C1N)[N+](=O)[O-])OC

InChIKey

WLKUQCUVDUFSAO-UHFFFAOYSA-N

InChI

InChI=1S/C8H10N2O3/c1-5-3-6(13-2)4-7(8(5)9)10(11)12/h3-4H,9H2,1-2H3

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Work with 4-Methoxy-2-methyl-6-nitroaniline

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,4-Dimethyl-6-nitroaniline1635-84-363 % similar 4-Methoxy-1-methyl-2-nitrobenzene17484-36-562 % similar 3-Methyl-4-nitroanisole5367-32-862 % similar 4-Chloro-2-methyl-6-nitroaniline62790-50-560 % similar 4-Bromo-2-methyl-6-nitrobenzenamine77811-44-060 % similar 4-Methoxy-2-nitroaniline96-96-857 % similar 5-Methoxy-2-nitrobenzenamine16133-49-655 % similar 2-Methyl-6-nitroaniline570-24-153 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3,5-Dimethyl-4-nitro-2-pyridinemethanol149082-03-1 HC Yellow 24926-55-0 Ethyl 4-hydroxy-2-methylpyrimidine-5-carboxylate53135-24-3 4-Ethoxy-2-nitroaniline616-86-4 2,3,5-Trimethyl-4-nitropyridine 1-oxide86604-79-7

Elsewhere

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