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Reference substances

Reference substances

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General information

Inventory

EC number:
257-765-0
EC name:
2-[(3-aziridin-1-ylpropionyl)methyl]-2-ethylpropane-1,3-diyl bis(aziridine-1-propionate)
CAS number:
52234-82-9

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Reference substance information

IUPAC name:
6-(aziridin-1-yl)-2-({[3-(aziridin-1-yl)propanoyl]oxy}methyl)-2-ethyl-4-oxohexyl 3-(aziridin-1-yl)propanoate
Synonyms
Names:
1-Aziridinepropanoic acid, 2- 3-(1-aziridinyl)-1-oxopropoxy methyl -2-ethyl-1,3-propanediyl ester
1-Aziridinepropanoic acid, 2-[[3-(1-aziridinyl)-1-oxopropoxy]methyl]-2-ethyl-1,3-propanediyl ester
6-aziridin-1-yl-2-{[(3-aziridin-1-ylpropanoyl)oxy]methyl}-2-ethyl-4-oxohexyl 3-aziridin-1-ylpropanoate (non-preferred name)

CAS information

CAS number:
52234-82-9

Molecular and structural information

Molecular formula:
C21H35N3O6
Molecular weight:
425.5
SMILES notation:
CCC(COC(=O)CCN1CC1)(COC(=O)CCN2CC2)COC(=O)CCN3CC3
InChl:
1S/C21H35N3O6/c1-2-21(15-28-18(25)3-6-22-9-10-22,16-29-19(26)4-7-23-11-12-23)17-30-20(27)5-8-24-13-14-24/h2-17H2,1H3
Structural formula:
Chemical structure