2613-27-6

Name 4-NITROPHENYLSULFUR PENTAFLUORIDE
CAS 2613-27-6
EINECS(EC#) 447-610-7
Molecular Formula C6H4F5NO2S
MDL Number MFCD00221619
Molecular Weight 249.16
MOL File 2613-27-6.mol

Chemical Properties

Melting point  38 °C
Boiling point  76-77°C 12mm
refractive index  1.4729
Fp  76-77°C/12mm
storage temp.  2-8°C, stored under nitrogen
solubility  Soluble in acetonitrile
Water Solubility  Insoluble in water
form  powder to lump to clear liquid
color  White or Colorless to Yellow
BRN  1986023
Henry's Law Constant 1.6×10-1 mol/(m3Pa) at 25℃, Ebert et al. (2023)
InChI InChI=1S/C6H4F5NO2S/c7-15(8,9,10,11)6-3-1-5(2-4-6)12(13)14/h1-4H
InChIKey AGNCKMHGYZKMLN-UHFFFAOYSA-N
SMILES C1(=CC=C([N+]([O-])=O)C=C1)S(F)(F)(F)(F)F
CAS DataBase Reference 2613-27-6(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Skull and Crossbones (GHS06)Exclamation Mark (GHS07)
GHS06,GHS07
Signal word  Danger
Hazard statements  H301+H311+H331-H315-H319-H301-H311-H331
Precautionary statements  P301+P310a-P305+P351+P338-P501a-P261-P264-P270-P271-P280-P301+P310+P330-P302+P352+P312+P361+P364-P304+P340+P311-P305+P351+P338+P337+P313-P403+P233-P405-P501
Hazard Codes  Xi,T
Risk Statements 
R34:Causes burns.
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
RIDADR  3261
Hazard Note  Toxic/Irritant
TSCA  No
REACH Registrations Inactive
HazardClass  6.1
PackingGroup  III
HS Code  2929900090

Hazard Information

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