1,3,5-Trimethyl-2,4,6-trinitrobenzene

Modify Date: 2026-07-08 12:05:07

1,3,5-Trimethyl-2,4,6-trinitrobenzene Structure
1,3,5-Trimethyl-2,4,6-trinitrobenzene structure
Common Name 1,3,5-Trimethyl-2,4,6-trinitrobenzene
CAS Number 602-96-0 Molecular Weight 255.18400
Density 1.468g/cm3 Boiling Point 366.1ºC at 760 mmHg
Molecular Formula C9H9N3O6 Melting Point N/A
MSDS N/A Flash Point 173.4ºC

 Names

Name 1,3,5-trimethyl-2,4,6-trinitrobenzene
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.468g/cm3
Boiling Point 366.1ºC at 760 mmHg
Molecular Formula C9H9N3O6
Molecular Weight 255.18400
Flash Point 173.4ºC
Exact Mass 255.04900
PSA 137.46000
LogP 3.90600
Index of Refraction 1.611
InChIKey YVJCXMCIFPUNDO-UHFFFAOYSA-N
SMILES Cc1c([N+](=O)[O-])c(C)c([N+](=O)[O-])c(C)c1[N+](=O)[O-]

 Synthetic Route

 1,3,5-Trimethyl-2,4,6-trinitrobenzeneBioassay

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Name: NCI human tumor cell line growth inhibition assay. Data for the MCF7 Non-Small Cell L...
Source: DTP/NCI
Target: N/A
External Id: MCF7_OneDose
Name: NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
Source: DTP/NCI
Target: N/A
External Id: IGROV1_OneDose
Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN
Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN
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 Synonyms

1,3,5-trinitromesitylene
1,3,5-trimethyl-2,4,6-trinitro-benzene
2,6-Trinitromesitylene
1,3,5-Trimethyl-2,4,6-trinitro-benzol
Trinitromesitylene
Mesitylene,4,6-trinitro
2,4,6-Trinitromesitylene
1,3,5-trinitro-2,4,6-tri-methyl benzene
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