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4-tert-Butylthiophenol Structure

4-tert-Butylthiophenol

  • Product Name4-tert-Butylthiophenol
  • CAS2396-68-1
  • CBNumberCB7687697
  • MFC10H14S
  • MW166.28
  • EINECS219-255-6
  • MDL NumberMFCD00022067
  • MOL File2396-68-1.mol

Chemical Properties

Melting point: -11 °C
Boiling point: 120 °C/22 mmHg
Density  0.99
refractive index  1.55
Flash point: > 110 °C - closed cup
storage temp.  Inert atmosphere,Room Temperature
pka 6.76±0.10(Predicted)
form  clear liquid
color  Colorless to Light yellow
Water Solubility  Insoluble in water.
Sensitive  Air Sensitive
BRN  606476
InChI 1S/C10H14S/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7,11H,1-3H3
InChIKey GNXBFFHXJDZGEK-UHFFFAOYSA-N
SMILES CC(C)(C)c1ccc(S)cc1
CAS DataBase Reference 2396-68-1(CAS DataBase Reference)
EPA Substance Registry System Benzenethiol, 4-(1,1-dimethylethyl)- (2396-68-1)

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs Respiratory system
PPE Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
RIDADR  UN 3334
WGK Germany  3
RTECS  DC1025000
Hazard Note  Harmful/Irritant
HS Code  2930909099
Storage Class 10 - Combustible liquids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
NFPA 704:
1
2 0

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