7-Methyl-8-nitroquinoline

C₁₀H₈N₂O₂CAS 7471-63-8188.19 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₈N₂O₂
Molar mass: 188.19 g/mol
Exact mass: 188.0586 Da
Melting point: 183 °C
logP: 2.45Crippen estimate
Polar surface area: 56.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Hazards

Warning

H315 Causes skin irritation20% of notifiers
H319 Causes serious eye irritation20% of notifiers
H341 Suspected of causing genetic defects80% of notifiers

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P264, P264+P265, P280, P302+P352, P305+P351+P338, P318, P321, P332+P317, P337+P317, P362+P364, P405, P501

Identifiers

CAS number

7471-63-8

SMILES

Cc1ccc2cccnc2c1[N+](=O)[O-]

InChIKey

ZZDTVYJYMRSNQL-UHFFFAOYSA-N

InChI

InChI=1S/C10H8N2O2/c1-7-4-5-8-3-2-6-11-9(8)10(7)12(13)14/h2-6H,1H3

Weigh it out

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

Names and synonyms

3 names

Quinoline, 7-methyl-8-nitro-
8-Nitro-7-methylquinoline
NSC 401260

Work with 7-Methyl-8-nitroquinoline

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-Methyl-1-nitronaphthalene881-03-859 % similar 8-Nitroquinoline607-35-256 % similar 3-Methyl-2-nitropyridine18368-73-554 % similar 2,6-Dimethylnitrobenzene81-20-953 % similar 2-Fluoro-3-nitro-4-picoline19346-43-150 % similar 2-Chloro-4-methyl-3-nitropyridine23056-39-550 % similar 2-Bromo-3-nitro-4-picoline23056-45-350 % similar 2-Amino-4-methyl-3-nitropyridine6635-86-550 % similar

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

Same formula

4-(1H-Pyrazol-4-yl)benzoic acid1017794-47-6 4-(1H-Imidazol-2-yl)benzoic Acid108035-45-6 3-(1H-Imidazol-1-yl)benzoic acid108035-47-8 5-Phenyl-1H-pyrazole-3-carboxylic acid1134-49-2 1-Phenyl-1H-pyrazole-4-carboxylic acid1134-50-5 3-(4-Hydroxyphenyl)-2(1H)-pyrazinone126247-63-0 2-(1H-Imidazol-1-yl)benzoic acid159589-67-0 4-(1H-Pyrazol-1-yl)benzoic acid16209-00-0

Elsewhere

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