4-Ethoxy-2-nitroaniline

C₈H₁₀N₂O₃CAS 616-86-4182.18 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
Melting point: 109–110 °C
logP: 1.58Crippen estimate
Polar surface area: 78.4 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 3

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, 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

616-86-4

SMILES

CCOc1ccc(N)c([N+](=O)[O-])c1

InChIKey

ISFYBUAVOZFROB-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

9 names

Benzenamine, 4-ethoxy-2-nitro-
p-Phenetidine, 2-nitro-
4-Ethoxy-2-nitrobenzenamine
4-Amino-3-nitrophenetole
2-Nitro-p-phenetidine
NSC 1320
NSC 58160
(4-Ethoxy-2-nitrophenyl)amine
2-Nitro-4-ethoxyaniline

Work with 4-Ethoxy-2-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

1,4-Diethoxy-2-nitrobenzene119-23-369 % similar 4-Methoxy-2-nitroaniline96-96-868 % similar 2-Nitro-4-(trifluoromethoxy)aniline2267-23-458 % similar P-Nitrophenetole100-29-856 % similar 4-Methyl-2-nitroaniline89-62-355 % similar 2-Nitro-4-phenylenediamine5307-14-254 % similar 2,4-Dinitroaniline97-02-954 % similar 5-Methoxy-2-nitrobenzenamine16133-49-654 % 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-Methoxy-2-methyl-6-nitroaniline684237-54-5 2,3,5-Trimethyl-4-nitropyridine 1-oxide86604-79-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook