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Structure

1,3-Dimethyl-5-nitrobarbituric acid

CAS
14305-99-8
Catalog Number
ACM14305998
Category
Other Products
Molecular Weight
201.137
Molecular Formula
C6H6N3NaO5

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Specification

Synonyms
1,3-Dimethyl-5-nitrobarbituric acid;1,3-Dimethyl-5-nitrobarbituric acid sodium salt
IUPAC Name
1,3-dimethyl-5-nitro-1,3-diazinane-2,4,6-trione
Canonical SMILES
CN1C(=O)C(C(=O)N(C1=O)C)[N+](=O)[O-]
InChI Key
XMNHVEFLJGTPDJ-UHFFFAOYSA-N
Boiling Point
337.3ºC at 760mmHg
Flash Point
157.8ºC
Density
1.58g/cm³
Exact Mass
201.03900
H-Bond Acceptor
5
H-Bond Donor
0
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