1642-54-2

Product Name: DIETHYLCARBAMAZINE CITRATE

Formula: C16H29N3O8

Synonyms: N,N-Diethyl-4-methyl-1-piperazinecarboxamide citrate salt;Diethylcarbamazine citrate salt

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CHEMICAL AND PHYSICAL PROPERTIES SAFETY INFORMATION COMPUTED DESCRIPTORS PRODUCT INTRODUCTION RELATED SUPPLIERS

CHEMICAL AND PHYSICAL PROPERTIES

Physical Description	Diethylcarbamazine citrate is a crystalline solid, scored white tablets. Used against filariasis in man and animals. (EPA, 1998)
Color/Form	White, crystalline powder
Odor	Odorless or slight odor
Taste	Bitter acid taste
Melting Point	286 to 289 °F (EPA, 1998)
Solubility	> 75% in water @ 20 °C
Stability/Shelf Life	The product /as tablets/ is stable even under conditions of high temp and humidity.
Decomposition	When heated to decomposition it emits ... fumes of nitrogen oxides.
Collision Cross Section	144.6 Å² [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]
Other Experimental Properties	Slightly hygroscopic

Signal word	Danger
Pictogram(s)	Skull and Crossbones Acute Toxicity GHS06
GHS Hazard Statements	H302:Acute toxicity,oral H330:Acute toxicity,inhalation
Precautionary Statement Codes	P260:Do not breathe dust/fume/gas/mist/vapours/spray. P403+P233:Store in a well-ventilated place. Keep container tightly closed.

Molecular Weight	391.42 g/mol
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	7
Exact Mass	391.19546489 g/mol
Monoisotopic Mass	391.19546489 g/mol
Topological Polar Surface Area	159 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	411
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