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Home >> Chemical Listing >> Page 635 >> N-(1,3-Benzodioxol-5-Ylmethyl)-3-Oxo-Butanamide

N-(1,3-Benzodioxol-5-Ylmethyl)-3-Oxo-Butanamide
[CAS# 16386-35-9]

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Identification
Name N-(1,3-Benzodioxol-5-Ylmethyl)-3-Oxo-Butanamide
Synonyms N-(1,3-Benzodioxol-5-Ylmethyl)-3-Oxo-Butanamide; N-(1,3-Benzodioxol-5-Ylmethyl)-3-Keto-Butyramide; Nsc96630
Molecular Structure CAS#: 16386-35-9, N-(1,3-Benzodioxol-5-Ylmethyl)-3-Oxo-Butanamide
Molecular Formula C12H13NO4
Molecular Weight 235.24
CAS Registry Number 16386-35-9
SMILES C1=C(CNC(CC(C)=O)=O)C=CC2=C1OCO2
InChI 1S/C12H13NO4/c1-8(14)4-12(15)13-6-9-2-3-10-11(5-9)17-7-16-10/h2-3,5H,4,6-7H2,1H3,(H,13,15)
InChIKey WNOBCCBHRGNWFB-UHFFFAOYSA-N
Properties
Density 1.265g/cm3 (Cal.)
Boiling point 468.039°C at 760 mmHg (Cal.)
Flash point 236.862°C (Cal.)
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