2-(4-Nitrophenyl)pyridine

C₁₁H₈N₂O₂CAS 4282-47-7200.20 g/mol

Open in Covalent MOL file

Nitro

Properties

Molecular formula: C₁₁H₈N₂O₂
Molar mass: 200.20 g/mol
Exact mass: 200.0586 Da
logP: 2.66Crippen estimate
Polar surface area: 56.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

Hazards

Danger

H301 Toxic if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage100% 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+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

4282-47-7

SMILES

C1=CC=NC(=C1)C2=CC=C(C=C2)[N+](=O)[O-]

InChIKey

FNLTWLXKZQWUJZ-UHFFFAOYSA-N

InChI

InChI=1S/C11H8N2O2/c14-13(15)10-6-4-9(5-7-10)11-3-1-2-8-12-11/h1-8H

Weigh it out

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

Work with 2-(4-Nitrophenyl)pyridine

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

4-Nitro-1,1'-biphenyl92-93-359 % similar 4,4'-Dinitro-1,1'-biphenyl1528-74-157 % similar 1,4-Dinitrobenzene100-25-452 % similar 2-Phenylpyridine1008-89-552 % similar Nitrobenzene98-95-352 % similar 4-(4-Nitrophenyl)-1,2,3-thiadiazole82894-98-251 % similar 3-(4-Nitrophenyl)-1H-pyrazole20583-31-749 % similar 4-(2-Pyridinyl)benzaldehyde127406-56-849 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

[2,2′-Bipyridine]-4-carboxylic acid1748-89-6 4-(3-Nitrophenyl)pyridine4282-48-8

Elsewhere

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