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3,4,5-Trinitrotoluene

3,4,5-Trinitrotoluene structure

CAS No:
603-15-6
Formula:
C7H5N3O6
Chemical Name:
3,4,5-Trinitrotoluene
Synonyms:
Benzene,5-methyl-1,2,3-trinitro-;Toluene,3,4,5-trinitro-;5-Methyl-1,2,3-trinitrobenzene;3,4,5-Trinitrotoluene

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3,4,5-Trinitrotoluene Basic Attributes

Molecular Weight：

227.132

Exact Mass：

227.13

DSSTox ID：

DTXSID00209051

Characteristics

PSA：

138

XLogP3：

3.28920

Density：

1.608g/cm3

Melting Point：

137.5 °C

Boiling Point：

448.4ºC at 760 mmHg

Flash Point：

242.6ºC

Refractive Index：

1.637

Computed Properties

Molecular Weight:227.13
XLogP3:1.8
Hydrogen Bond Acceptor Count:6
Exact Mass:227.01783489
Monoisotopic Mass:227.01783489
Topological Polar Surface Area:138
Heavy Atom Count:16
Complexity:292
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,4,5-Trinitrotoluene

Basic Attributes
Characteristics
Computed Properties

3,4,5-Trinitrotoluene

SDS

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