2-Methoxy-6-nitrobenzenamine

C₇H₈N₂O₃CAS 16554-45-3168.15 g/mol

Open in Covalent MOL file

Ether Nitro Primary amine

Properties

Molecular formula: C₇H₈N₂O₃
Molar mass: 168.15 g/mol
Exact mass: 168.0535 Da
Melting point: 67 °C
logP: 1.19Crippen estimate
Polar surface area: 78.4 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 2

Hazards

Danger

H301 Toxic if swallowed50% of notifiers
H302 Harmful if swallowed50% of notifiers
H312 Harmful in contact with skin50% of notifiers
H315 Causes skin irritation50% of notifiers
H319 Causes serious eye irritation50% of notifiers
H332 Harmful if inhaled50% of notifiers
H335 May cause respiratory irritation50% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

16554-45-3

SMILES

COc1cccc([N+](=O)[O-])c1N

InChIKey

NDKWDGCTUOOAPF-UHFFFAOYSA-N

InChI

InChI=1S/C7H8N2O3/c1-12-6-4-2-3-5(7(6)8)9(10)11/h2-4H,8H2,1H3

Weigh it out

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

Names and synonyms

9 names

Benzenamine, 2-methoxy-6-nitro-
o-Anisidine, 6-nitro-
2-Amino-3-nitroanisole
2-Methoxy-6-nitroaniline
6-Nitro-o-anisidine
2-Amino-3-methoxynitrobenzene
6-Methoxy-2-nitroaniline
(2-Methoxy-6-nitrophenyl)amine
2-Amino-3-nitro-1-methoxybenzene

Work with 2-Methoxy-6-nitrobenzenamine

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

O-Nitroanisole91-23-668 % similar 2,6-Dinitroaniline606-22-466 % similar 1-Methoxy-2-methyl-3-nitrobenzene4837-88-165 % similar 2-Bromo-3-nitroanisole67853-37-663 % similar 3-Nitro-1,2-phenylenediamine3694-52-863 % similar 2-Methyl-6-nitroaniline570-24-159 % similar Methyl 3-nitroanthranilate57113-91-457 % similar 2-Bromo-6-nitrobenzenamine59255-95-757 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Methoxy-6-methyl-3-nitropyridine112163-03-8 2,4-Dihydroxybenzhydrazide13221-86-8 3,5-Dimethyl-4-nitropyridine 1-oxide14248-66-9 5-Methoxy-2-nitrobenzenamine16133-49-6 2-Hydroxymethyl-3-methyl-4-nitropyridine168167-49-5 4-Ethoxy-3-nitropyridine1796-84-5 5-Amino-2-methoxy-4-pyridinecarboxylic acid183741-91-5 2-Ethoxy-5-nitropyridine31594-45-3

Elsewhere

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