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Desethyldesisopropylatrazine-[13C3]

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General Information
Catalog: BLP-007319
CAS: 1216850-33-7
Molecular Formula: [13C]3H4ClN5
Molecular Weight: 148.53

Chemical Structure

Description	Desethyldesisopropylatrazine-[13C3] is the labelled analogue of Desethyldesisopropylatrazine, which is a metabolite of Atrazine.
Synonyms	6-Chloro-2,4-diamino-1,3,5-triazine-13C3; Desethyldesisopropyl Atrazine-13C3; 2,4-Diamino-6-chloro-1,3,5-triazine-13C3; 2,4-Diamino-6-chloro-s-triazine-13C3; NSC 680830-13C3; 2,4-Diamino-6-chlorotriazine-13C3; 2-Chloro-1,3,5-triazine-4,6-diamine-13C3; NSC 7965-13C3; 2-Chloro-4,6-bis(amino)-1,3,5-triazine-13C3; 2-Chloro-4,6-bisamino-s-triazine-13C3; Chloroammeline-13C3; DACT-13C3; Deethyldeisopropylatrazine-13C3; Deisopropyldeethyl Atrazine-13C3; Didealkylatrazine-13C3
IUPAC Name	6-chloro-(2,4,6-13C3)1,3,5-triazine-2,4-diamine
Related CAS	3397-62-4 (unlabelled)
Canonical SMILES	C1(=NC(=NC(=N1)Cl)N)N
InChI	InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)/i1+1,2+1,3+1
InChI Key	FVFVNNKYKYZTJU-VMIGTVKRSA-N
Melting Point	>300°C
Purity	95% by CP; 99% atom 13C
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly, Heated, Sonicated)
Appearance	White to Off-white Solid
Storage	Store at -20°C under inert atmosphere