4-Methoxy-2-nitrophenol

C7H7NO4CAS 1568-70-3169.14 g/mol

Open in Covalent MOL file
OOHN+OO−
EtherNitroPhenol

Properties

Molecular formula
C7H7NO4
Molar mass
169.14 g/mol
Exact mass
169.0375 Da
logP
1.31Crippen estimate
Polar surface area
72.6 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
1568-70-3
SMILES
COC1=CC(=C(C=C1)O)[N+](=O)[O-]
InChIKey
YBUGOACXDPDUIR-UHFFFAOYSA-N
InChI
InChI=1S/C7H7NO4/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4,9H,1H3

Weigh it out

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Names and synonyms

1 names
  • Phenol, 4-methoxy-2-nitro-

Work with 4-Methoxy-2-nitrophenol

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-Dimethoxy-2-nitrobenzene89-39-467 % similar 4-Methoxy-1-methyl-2-nitrobenzene17484-36-565 % similar 4-Methoxy-2-nitroaniline96-96-865 % similar 4-Methoxy-2-nitrobenzaldehyde22996-21-064 % similar 1-Chloro-4-methoxy-2-nitrobenzene10298-80-363 % similar 1-Bromo-4-methoxy-2-nitrobenzene5344-78-563 % similar 4-Iodo-3-nitroanisole58755-70-763 % similar 4-Fluoro-3-nitroanisole61324-93-463 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Methoxy-3-nitrophenol15174-02-4 3-Methoxy-4-nitrophenol16292-95-8 2-Methoxy-4-nitrophenol3251-56-7 N-Succinimidyl acrylate38862-24-7 4-Hydroxy-3-nitrobenzyl alcohol41833-13-0 3,4,5-Trihydroxybenzamide618-73-5 5-Nitroguaiacol636-93-1 5-Methoxy-2-nitrophenol704-14-3

Elsewhere

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