2,6-Dinitro-4-fluorophenol

C₆H₃FN₂O₅CAS 364-32-9202.10 g/mol

Open in Covalent MOL file

Aryl halide Nitro Phenol

Properties

Molecular formula: C₆H₃FN₂O₅
Molar mass: 202.10 g/mol
Exact mass: 202.0026 Da
logP: 1.35Crippen estimate
Polar surface area: 106.5 Å²
H-bond donors / acceptors: 1 / 5
Rotatable bonds: 2

Hazards

Warning

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

Aggregated from 4 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

364-32-9

SMILES

C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])F

InChIKey

MDOWEUXXLVBZIU-UHFFFAOYSA-N

InChI

InChI=1S/C6H3FN2O5/c7-3-1-4(8(11)12)6(10)5(2-3)9(13)14/h1-2,10H

Weigh it out

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Names and synonyms

1 names

4-Fluoro-2,6-dinitrophenol

Work with 2,6-Dinitro-4-fluorophenol

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-Difluoro-6-nitrophenol364-31-879 % similar Picric acid88-89-168 % similar 2,6-Dinitro-p-cresol609-93-863 % similar 2,6-Dinitro-4-(trifluoromethyl)phenol393-77-163 % similar Styphnic acid82-71-362 % similar Dunnite131-74-861 % similar 4-Fluoro-2-nitrophenol394-33-259 % similar 2,6-Dinitrophenol573-56-859 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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