Name: Hydroxy Atrazine-[d5]
Brand: BOC Sciences
Rating: 5 (1 reviews)

General Information

Catalog: BLP-013719

CAS: 1276197-25-1

Molecular Formula: C8H10D5N5O

Molecular Weight: 202.27

Chemical Structure

Description	Hydroxy Atrazine-[d5] is the labelled analogue of Hydroxy Atrazine, which is a major metabolite of Atrazine.
Synonyms	Hydroxy Atrazine-d5; 4-(Ethylamino-d5)-6-[(1-methylethyl)amino]-1,3,5-triazin-2(1H)-one; 4-(Ethylamino-d5)-6-(isopropylamino)-s-triazin-2-ol; 2-Hydroxy-4-(ethylamino-d5)-6-isopropylamino-s-triazine; 2-Hydroxyatrazine-d5; 2-Oxy-4-(ethylamino-d5)-6-(isopropylamino)-s-triazine; Atrazine-d5 Hydroxy; Hydroxyatrazine-d5; N-(Ethyl-d5)-6-hydroxy-N'-(1-methylethyl)-1,3,5-triazine-2,4-diamine
IUPAC Name	4-(1,1,2,2,2-pentadeuterioethylamino)-6-(propan-2-ylamino)-1H-1,3,5-triazin-2-one
Related CAS	2163-68-0 (unlabelled)
Canonical SMILES	CCNC1=NC(=O)NC(=N1)NC(C)C
InChI	InChI=1S/C8H15N5O/c1-4-9-6-11-7(10-5(2)3)13-8(14)12-6/h5H,4H2,1-3H3,(H3,9,10,11,12,13,14)/i1D3,4D2
InChI Key	NFMIMWNQWAWNDW-SGEUAGPISA-N
Melting Point	>273°C (dec.)
Purity	≥97%; ≥98% atom D
Solubility	Soluble in Aqueous Acid (Slightly, Heated), Aqueous Base (Slightly), Methanol (Slightly)
Appearance	White to Off-white Solid
Storage	Store at -20°C under inert atmosphere