Xylazine hydrochloride

C₁₂H₁₇ClN₂SCAS 23076-35-9256.79 g/mol

Open in Covalent MOL file

Sulfide

Properties

Molecular formula: C₁₂H₁₇ClN₂S
Molar mass: 256.79 g/mol
Exact mass: 256.0801 Da
logP: 3.63Crippen estimate
Polar surface area: 24.4 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Hazards

Danger

H301 Toxic if swallowed95% of notifiers
H315 Causes skin irritation60% of notifiers
H318 Causes serious eye damage30% of notifiers
H319 Causes serious eye irritation58.8% of notifiers
H335 May cause respiratory irritation58.8% of notifiers
H412 Harmful to aquatic life with long lasting effects30% of notifiers

Aggregated from 80 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

23076-35-9

SMILES

Cc1cccc(C)c1NC1=NCCCS1.Cl

InChIKey

QYEFBJRXKKSABU-UHFFFAOYSA-N

InChI

InChI=1S/C12H16N2S.ClH/c1-9-5-3-6-10(2)11(9)14-12-13-7-4-8-15-12;/h3,5-6H,4,7-8H2,1-2H3,(H,13,14);1H

Weigh it out

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

Names and synonyms

13 names · show all

4H-1,3-Thiazin-2-amine, N-(2,6-dimethylphenyl)-5,6-dihydro-, hydrochloride (1:1)
4H-1,3-Thiazine, 5,6-dihydro-2-(2,6-xylidino)-, monohydrochloride
4H-1,3-Thiazin-2-amine, N-(2,6-dimethylphenyl)-5,6-dihydro-, monohydrochloride
5,6-Dihydro-2-(2,6-xylidino)-4H-1,3-thiazine hydrochloride
BAY-Va 1470
Rompun
BAY 1470 hydrochloride
Celactal
Xylazine chloride
Narcosyl
Xylapan
Xylasol
Xylaxin

Work with Xylazine 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.

Xylazine7361-61-7Free base

Similar compounds

N-(2,6-Dimethylphenyl)thiourea6396-76-536 % similar [(2,6-Dimethylphenyl)amino](oxo)acetic acid2903-48-234 % similar Clonidine hydrochloride4205-91-832 % similar 2,6-Dimethylaniline hydrochloride21436-98-632 % similar 7-Methylisatin1127-59-931 % similar Hydrazine, (2,3-dimethylphenyl)-, hydrochloride, hydrate (1:1:?)123333-92-631 % similar Lidocaine hydrochloride monohydrate6108-05-031 % similar 2,3-Dimethylphenylhydrazine hydrochloride56737-75-830 % similar

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

Elsewhere

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