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2-hydroxy-3-nitrocyclohepta-2,4,6-trien-1-one

2-hydroxy-3-nitrocyclohepta-2,4,6-trien-1-one structure

CAS No:
33776-37-3
Formula:
C7H5NO4
Chemical Name:
2-hydroxy-3-nitrocyclohepta-2,4,6-trien-1-one
Synonyms:
33776-37-3;2-hydroxy-3-nitrocyclohepta-2,4,6-trien-1-one;7-nitrotropolone;3-Nitrotropolone;DTXSID50294917;NSC98689;NSC-98689;2-Hydroxy-7-nitrocyclohepta-2,4,6-trien-1-one

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2-hydroxy-3-nitrocyclohepta-2,4,6-trien-1-one Basic Attributes

Molecular Weight：

167.12 g/mol

Exact Mass：

167.02185764 g/mol

NSC Number：

98689

DSSTox ID：

DTXSID50294917

Characteristics

PSA：

83.1 Å²

Computed Properties

Molecular Weight:167.12
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Exact Mass:167.02185764
Monoisotopic Mass:167.02185764
Topological Polar Surface Area:83.1
Heavy Atom Count:12
Complexity:319
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-hydroxy-3-nitrocyclohepta-2,4,6-trien-1-one

Basic Attributes
Characteristics
Computed Properties

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