chempirical

4-(Trifluoromethoxy)benzoic acid hydrazide

C8H7F3N2O2CAS 175277-18-6220.15 g/mol

Open in Covalent MOL file
OHNH2NOFFF
Alkyl halideAmideEtherPrimary amine

Properties

Molecular formula
C8H7F3N2O2
Molar mass
220.15 g/mol
Exact mass
220.0460 Da
logP
1.19Crippen estimate
Polar surface area
64.4 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from the 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
175277-18-6
SMILES
C1=CC(=CC=C1C(=O)NN)OC(F)(F)F
InChIKey
QWYPNGTZNFACCP-UHFFFAOYSA-N
InChI
InChI=1S/C8H7F3N2O2/c9-8(10,11)15-6-3-1-5(2-4-6)7(14)13-12/h1-4H,12H2,(H,13,14)

Weigh it out

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

Work with 4-(Trifluoromethoxy)benzoic 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

Terephthalic dihydrazide136-64-160 % similar 4-(Trifluoromethoxy)benzamide456-71-360 % similar 4-Methoxybenzohydrazide3290-99-158 % similar p-(Trifluoromethyl)benzoylhydrazine339-59-358 % similar 4-Fluorobenzoic acid hydrazide456-06-454 % similar 4-(Trifluoromethoxy)benzoic acid330-12-154 % similar 4-Trifluoromethoxybenzoyl chloride36823-88-854 % similar 1-[4-(Trifluoromethoxy)phenyl]ethanone85013-98-554 % similar

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

Same formula

6-Methoxy-4-(trifluoromethyl)pyridine-3-carboxamide175204-87-2 2-(Trifluoromethoxy)benzoic hydrazide175277-19-7 Ethyl 2-(trifluoromethyl)pyrimidine-5-carboxylate304693-64-9 4-(Trifluoromethoxy)benzamidoxime56935-71-8

Elsewhere

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