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1,1,1-Trinitropropane

1,1,1-Trinitropropane structure

CAS No:
5437-63-8
Formula:
C3H5N3O6
Chemical Name:
1,1,1-Trinitropropane
Synonyms:
Propane,1,1,1-trinitro-;1,1,1-Trinitropropane;NSC 16154

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1,1,1-Trinitropropane Basic Attributes

Molecular Weight：

179.088

Exact Mass：

179.09

NSC Number：

16154

DSSTox ID：

DTXSID60202745

Characteristics

PSA：

138

XLogP3：

0.9

Density：

1.3938 g/cm³ @ Temp: 22 °C

Melting Point：

-57.7 °C

Boiling Point：

23 °C @ Press: 2 Torr

Computed Properties

Molecular Weight:179.09
XLogP3:0.9
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:179.01783489
Monoisotopic Mass:179.01783489
Topological Polar Surface Area:138
Heavy Atom Count:12
Complexity:184
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,1,1-Trinitropropane

Basic Attributes
Characteristics
Computed Properties

1,1,1-Trinitropropane

SDS

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