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72214-67-6

72214-67-6 structural image
Product Name: TIMTEC-BB SBB005393
Formula: C8H9Cl3N2S
Synonyms: (2,4-Dichlorophenyl)carbamimidothioic acid methyl ester hydrochloride;2-(2,4-Dichlorobenzyl)-2-thiopseudourea hydrochloride;S-(2,4-Dichlorobenzyl)-isothiouronium hydrochloride
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.

COMPUTED DESCRIPTORS

Molecular Weight 271.6 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 269.955203 g/mol
Monoisotopic Mass 269.955203 g/mol
Topological Polar Surface Area 75.2 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 189
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes