2-Methoxy-4-nitrophenol

C₇H₇NO₄CAS 3251-56-7169.14 g/mol

Open in Covalent MOL file

Ether Nitro Phenol

Properties

Molecular formula: C₇H₇NO₄
Molar mass: 169.14 g/mol
Exact mass: 169.0375 Da
Melting point: 99–100 °C
logP: 1.31Crippen estimate
Polar surface area: 72.6 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 2

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation97.6% of notifiers

Aggregated from 42 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

3251-56-7

SMILES

COc1cc([N+](=O)[O-])ccc1O

InChIKey

IZLVFLOBTPURLP-UHFFFAOYSA-N

InChI

InChI=1S/C7H7NO4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3

Weigh it out

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

Names and synonyms

8 names

Guaiacol, 4-nitro-
4-Hydroxy-3-methoxynitrobenzene
4-Nitroguaiacol
3-Nitro-6-hydroxyanisole
3-Methoxy-4-hydroxynitrobenzene
NSC 26149
4-Nitro-2-methoxyphenol
Phenol, 2-methoxy-4-nitro-

Work with 2-Methoxy-4-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

1,2-Dimethoxy-4-nitrobenzene709-09-171 % similar 2-Methoxy-1-methyl-4-nitrobenzene13120-77-965 % similar 2-Methoxy-4-nitroaniline97-52-965 % similar 2-Methoxy-4-nitrobenzaldehyde136507-15-864 % similar 1-Chloro-2-methoxy-4-nitrobenzene1009-36-563 % similar 2-Iodo-5-nitroanisole5458-84-463 % similar 1-Bromo-2-methoxy-4-nitrobenzene77337-82-763 % similar 2-Cyano-5-nitroanisole101084-96-263 % similar

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

Same formula

4-Methoxy-3-nitrophenol15174-02-4 4-Methoxy-2-nitrophenol1568-70-3 3-Methoxy-4-nitrophenol16292-95-8 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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