2,6-Toluenediisocyanate-MOPP-adduct
Product Code
DRE-C17594620
CAS Number
Product Format
Neat
Lot Number
1157877
Expiry
2025-07-22
Molecular Formula
C31 H38 N6 O4
Molecular Weight
558.6712
Product Categories
Product Type
MetaboliteDocumentation
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Product Information
Analyte Data
Analyte Name
2,6-Toluenediisocyanate-MOPP-adduct
CAS Number
1993243-17-6
Molecular Formula
C31 H38 N6 O4
Molecular Weight
558.6712
Accurate Mass
558.2955
SMILES
COc1ccccc1N2CCN(CC2)C(=O)Nc3cccc(NC(=O)N4CCN(CC4)c5ccccc5OC)c3C
InChI
InChI=1S/C31H38N6O4/c1-23-24(32-30(38)36-19-15-34(16-20-36)26-11-4-6-13-28(26)40-2)9-8-10-25(23)33-31(39)37-21-17-35(18-22-37)27-12-5-7-14-29(27)41-3/h4-14H,15-22H2,1-3H3,(H,32,38)(H,33,39)
IUPAC
4-(2-methoxyphenyl)-N-[3-[[4-(2-methoxyphenyl)piperazine-1-carbonyl]amino]-2-methylphenyl]piperazine-1-carboxamide
Product Data
Storage Temperature
+20°C
Shipping Temperature
+20°C
Country of Origin
GERMANY
Product Type
Metabolite
Product Format
Neat
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