5-(1,3-Benzodioxol-5-ylmethyl)-2-(nitroamino)-1H-pyrimidin-4-one

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Catalog Number
ACM72716713
Product Name
5-(1,3-Benzodioxol-5-ylmethyl)-2-(nitroamino)-1H-pyrimidin-4-one
Structure
Structure
CAS
72716-71-3
Category
Heterocyclic Organic Compound
Synonyms
EINECS 276-779-8, 5-(1,3-Benzodioxol-5-ylmethyl)-2-(nitroamino)-1H-pyrimidin-4-one, 72716-71-3
IUPAC Name
N-[5-(1,3-benzodioxol-5-ylmethyl)-6-oxo-1H-pyrimidin-2-yl]nitramide
Molecular Weight
290.231600 [g/mol]
Molecular Formula
C12H10N4O5
Canonical SMILES
C1OC2=C(O1)C=C(C=C2)CC3=CN=C(NC3=O)N[N+](=O)[O-]
InChI Key
CYDVFWXIUURXJS-UHFFFAOYSA-N
Boiling Point
498.4ºC at 760 mmHg
Flash Point
255.2ºC
Density
1.7g/cm³
EC Number
276-779-8
Exact Mass
290.06500
H-Bond Acceptor
7
H-Bond Donor
2
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