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Tert-Butyl Peroxynitrate
[CAS# 42829-58-3]

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CAS#: 42829-58-3
Product: Tert-Butyl Peroxynitrate
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Identification
Name Tert-Butyl Peroxynitrate
Synonyms Tert-Butoxy Nitrate; Nitric Acid Tert-Butoxy Ester; Peroxynitric Acid, 1,1-Dimethylethyl Ester
Molecular Structure CAS#: 42829-58-3, Tert-Butyl Peroxynitrate
Molecular Formula C4H9NO4
Molecular Weight 135.12
CAS Registry Number 42829-58-3
SMILES CC(OO[N+]([O-])=O)(C)C
InChI 1S/C4H9NO4/c1-4(2,3)8-9-5(6)7/h1-3H3
InChIKey DOVINNYOVJDFQY-UHFFFAOYSA-N
Properties
Density 1.125g/cm3 (Cal.)
Boiling point 138.401°C at 760 mmHg (Cal.)
Flash point 47.728°C (Cal.)
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