(3,5-Bis(trifluoromethyl)phenyl)hydrazine hydrochloride

C₈H₇ClF₆N₂CAS 502496-23-3280.60 g/mol

Open in Covalent MOL file

Alkyl halide Primary amine Secondary amine

Properties

Molecular formula: C₈H₇ClF₆N₂
Molar mass: 280.60 g/mol
Exact mass: 280.0202 Da
logP: 3.43Crippen estimate
Polar surface area: 38.0 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin16.7% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled16.7% of notifiers
H335 May cause respiratory irritation83.3% of notifiers

Aggregated from 6 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

502496-23-3

SMILES

C1=C(C=C(C=C1C(F)(F)F)NN)C(F)(F)F.Cl

InChIKey

OPIOKSFIERNABH-UHFFFAOYSA-N

InChI

InChI=1S/C8H6F6N2.ClH/c9-7(10,11)4-1-5(8(12,13)14)3-6(2-4)16-15;/h1-3,16H,15H2;1H

Weigh it out

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

Names and synonyms

1 names

3,5-Bis(trifluoromethyl)phenylhydrazine hydrochloride

Work with (3,5-Bis(trifluoromethyl)phenyl)hydrazine hydrochloride

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

[3,5-Bis(trifluoromethyl)phenyl]hydrazine886-35-1Free base

Similar compounds

(3-(Trifluoromethyl)phenyl)hydrazine hydrochloride3107-33-367 % similar (4-(Trifluoromethyl)phenyl)hydrazine hydrochloride2923-56-064 % similar [3-(Trifluoromethyl)phenyl]hydrazine368-78-557 % similar 4-Trifluoromethylphenylhydrazine368-90-154 % similar 1,3,5-Tris(trifluoromethyl)benzene729-81-752 % similar 1-[3,5-Bis(trifluoromethyl)phenyl]-2-thiourea175277-17-548 % similar 3,5-Bis(trifluoromethyl)benzamidine hydrochloride97603-94-648 % similar [2,6-Dichloro-4-(trifluoromethyl)phenyl]hydrazine86398-94-948 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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