4-(Methylsulfonyl)phenylhydrazine hydrochloride

C₇H₁₁ClN₂O₂SCAS 17852-67-4222.69 g/mol

Open in Covalent MOL file

Primary amine Secondary amine Sulfone

Properties

Molecular formula: C₇H₁₁ClN₂O₂S
Molar mass: 222.69 g/mol
Exact mass: 222.0230 Da
logP: 0.80Crippen estimate
Polar surface area: 72.2 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 2

Hazards

Warning

H302 Harmful if swallowed66.7% of notifiers
H312 Harmful in contact with skin66.7% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled66.7% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 3 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

17852-67-4

SMILES

CS(=O)(=O)C1=CC=C(C=C1)NN.Cl

InChIKey

QVCMFSJTNVQJFG-UHFFFAOYSA-N

InChI

InChI=1S/C7H10N2O2S.ClH/c1-12(10,11)7-4-2-6(9-8)3-5-7;/h2-5,9H,8H2,1H3;1H

Weigh it out

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

Work with 4-(Methylsulfonyl)phenylhydrazine 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.

p-(Methylsulfonyl)phenylhydrazine877-66-7Free base

Similar compounds

4-Hydrazinylbenzenesulfonamide hydrochloride17852-52-759 % similar 4-Hydrazinobenzenesulfonamide hydrochloride27918-19-059 % similar 4-(Methylsulfonyl)aniline5470-49-552 % similar p-Hydrazinobenzenesulphonamide4392-54-550 % similar 4-Hydrazino-N-methylbenzenemethanesulfonamide hydrochloride88933-16-850 % similar 4-tert-Butylphenylhydrazine hydrochloride128231-55-048 % similar 4-Hydrazinobenzenesulfonic acid98-71-548 % similar Methyl p-tolyl sulfone3185-99-748 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

p-(Aminomethyl)benzenesulfonamide hydrochloride138-37-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook