Structure

Nibroxane

CAS
53983-00-9
Catalog Number
ACM53983009
Category
Other Products
Molecular Weight
226.02532
Molecular Formula
C5H8BrNO4

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Specification

Synonyms
NIBROXANE, Nibroxanum, Nibroxano, Compound 85287, Caswell No. 116AA, Nibroxane (USAN/INN), Nibroxanum [INN-Latin], Nibroxano [INN-Spanish], Lilly 85287, 5-Bromo-2-methyl-5-nitro-m-dioxane, MolPort-001-914-443, CID40955, EINECS 258-898-7, NSC290304, ZINC01482115, BAS 00096721, EPA Pesticide Chemical Code 116101, NSC 290304, 1,3-Dioxane, 5-bromo-2-methyl-5-nitro-, 5-Bromo-2-methyl-5-nitro-1,3-dioxane
IUPAC Name
5-bromo-2-methyl-5-nitro-1,3-dioxane
Canonical SMILES
CC1OCC(CO1)([N+](=O)[O-])Br
InChI Key
VFBSFSGHILWWIJ-UHFFFAOYSA-N
Boiling Point
280.3ºC at 760 mmHg
Flash Point
123.3ºC
Density
1.7g/cm³
EC Number
258-898-7
Exact Mass
224.96400
H-Bond Acceptor
4
H-Bond Donor
0
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