4-Nitrophenoxyacetic acid hydrazide

C₈H₉N₃O₄CAS 75129-74-7211.18 g/mol

Open in Covalent MOL file

Amide Ether Nitro Primary amine

Properties

Molecular formula: C₈H₉N₃O₄
Molar mass: 211.18 g/mol
Exact mass: 211.0593 Da
logP: -0.04Crippen estimate
Polar surface area: 107.5 Å²
H-bond donors / acceptors: 2 / 5
Rotatable bonds: 4

Hazards

Warning

H302 Harmful if swallowed20% of notifiers
H315 Causes skin irritation80% of notifiers
H319 Causes serious eye irritation80% of notifiers
H335 May cause respiratory irritation80% of notifiers

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

75129-74-7

SMILES

C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)NN

InChIKey

BDPKZWIKLVUGKS-UHFFFAOYSA-N

InChI

InChI=1S/C8H9N3O4/c9-10-8(12)5-15-7-3-1-6(2-4-7)11(13)14/h1-4H,5,9H2,(H,10,12)

Weigh it out

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

Work with 4-Nitrophenoxyacetic acid hydrazide

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-Nitrophenoxy)acetic acid1798-11-460 % similar 4-Fluorophenoxyacetic acid hydrazide1737-62-859 % similar 4-Nitrobenzoic acid hydrazide636-97-552 % similar P-Nitrophenetole100-29-851 % similar 1-(2-Bromoethoxy)-4-nitrobenzene13288-06-749 % similar 2-(4-Nitrophenoxy)ethanol16365-27-849 % similar 1-(2-Chloroethoxy)-4-nitrobenzene3383-72-049 % similar Bis(4-nitrophenyl) carbonate5070-13-349 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Nicorandil65141-46-0

Elsewhere

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