3-(1-oxidopyridin-4-yl)propane-1-thiol; 2,4,6-trinitrophenol

Modify Date: 2025-09-11 15:33:34

3-(1-oxidopyridin-4-yl)propane-1-thiol; 2,4,6-trinitrophenol Structure
3-(1-oxidopyridin-4-yl)propane-1-thiol; 2,4,6-trinitrophenol structure
Common Name 3-(1-oxidopyridin-4-yl)propane-1-thiol; 2,4,6-trinitrophenol
CAS Number 69603-72-1 Molecular Weight 398.34800
Density N/A Boiling Point 303.6ºC at 760 mmHg
Molecular Formula C14H14N4O8S Melting Point N/A
MSDS N/A Flash Point 133.9ºC

 Names

Name 3-(1-oxidopyridin-1-ium-4-yl)propane-1-thiol,2,4,6-trinitrophenol

 Chemical & Physical Properties

Boiling Point 303.6ºC at 760 mmHg
Molecular Formula C14H14N4O8S
Molecular Weight 398.34800
Flash Point 133.9ºC
Exact Mass 398.05300
PSA 221.95000
LogP 4.66390
InChIKey OEMSTJNAKKOLHW-UHFFFAOYSA-N
SMILES O=[N+]([O-])c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1.[O-][n+]1ccc(CCCS)cc1
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