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Simazine-[d5]

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General Information
Catalog: BLP-012112
CAS: 220621-41-0
Molecular Formula: C7H7D5ClN5
Molecular Weight: 206.69

Chemical Structure

Synonyms	Simazine D5 (ethyl D5); 6-Chlor-N-ethyl-N'-(2H5)ethyl-1,3,5-triazin-2,4-diamin
IUPAC Name	6-chloro-2-N-ethyl-4-N-(1,1,2,2,2-pentadeuterioethyl)-1,3,5-triazine-2,4-diamine
Related CAS	122-34-9 (unlabelled)
Canonical SMILES	CCNC1=NC(=NC(=N1)Cl)NCC
InChI	InChI=1S/C7H12ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H2,1-2H3,(H2,9,10,11,12,13)/i1D3,3D2
InChI Key	ODCWYMIRDDJXKW-WNWXXORZSA-N
Boiling Point	365.8±25.0 °C at 760 mmHg
Purity	95% atom D
Density	1.3±0.1 g/cm3
Storage	Store at -20°C