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Reference substances

Reference substances

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General information

Inventory

EC number:
260-568-2
EC name:
Pentaerythritol tris(3-aziridin-1-ylpropionate)
CAS number:
57116-45-7

No inventory information available

Reference substance information

IUPAC name:
3-[(3-aziridin-1-ylpropanoyl)oxy]-2-{[(3-aziridin-1-ylpropanoyl)oxy]methyl}-2-(hydroxymethyl)propyl 3-aziridin-1-ylpropanoate (non-preferred name)
Synonyms
Names:
1-Aziridinepropanoic acid, 2- 3-(1-aziridinyl)-1-oxopropoxy methyl -2-(hydroxymethyl)-1,3-propanedi
1-Aziridinepropanoic acid, 2-[[3-(1-aziridinyl)-1-oxopropoxy]methyl]-2-(hydroxymethyl)-1,3-propanediyl ester

CAS information

CAS number:
57116-45-7

Molecular and structural information

Molecular formula:
C20H33N3O7
Molecular weight:
427.492
SMILES notation:
OCC(COC(=O)CCN1CC1)(COC(=O)CCN2CC2)COC(=O)CCN3CC3
InChl:
InChI=1/C20H33N3O7/c24-13-20(14-28-17(25)1-4-21-7-8-21,15-29-18(26)2-5-22-9-10-22)16-30-19(27)3-6-23-11-12-23/h24H,1-16H2
Structural formula:
Chemical structure