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3-nitropentane-2,4-dione

3-nitropentane-2,4-dione structure

CAS No:
32113-67-0
Formula:
C5H7NO4
Chemical Name:
3-nitropentane-2,4-dione
Synonyms:
32113-67-0;3-nitropentane-2,4-dione;3-nitro-2,4-pentanedione;2,4-Pentanedione, 3-nitro-;3-Nitro-acetylaceton;3-Nitro-2,4-pentadione;SCHEMBL5404644;DTXSID60330951

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3-nitropentane-2,4-dione Basic Attributes

Molecular Weight：

145.11 g/mol

Exact Mass：

145.03750770 g/mol

DSSTox ID：

DTXSID60330951

Characteristics

PSA：

80 Å²

Computed Properties

Molecular Weight:145.11
XLogP3:-0.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:145.03750770
Monoisotopic Mass:145.03750770
Topological Polar Surface Area:80
Heavy Atom Count:10
Complexity:167
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-nitropentane-2,4-dione

Basic Attributes
Characteristics
Computed Properties

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