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4-tert-Butylbenzoic acid Structure

4-tert-Butylbenzoic acid

Chemical Properties

Melting point 162-165 °C(lit.)
Boiling point 280°C
Density  1.045 g/cm3 (30°C)
vapor pressure  <0.01 hPa (20 °C)
refractive index  1.5201 (estimate)
Flash point 180 °C
storage temp.  Store below +30°C.
solubility  12.6g/l
pka 4.38(at 25℃)
form  Solid
color  White to Off-White
PH 3.9 (H2O, 20℃)(saturated solution)
Water Solubility  0.07 g/L (20 ºC)
BRN  607545
InChIKey KDVYCTOWXSLNNI-UHFFFAOYSA-N
LogP 3.4 at 21℃
CAS DataBase Reference 98-73-7(CAS DataBase Reference)
EWG's Food Scores 1
FDA UNII 43Z7T3VN0R
NIST Chemistry Reference Benzoic acid, p-tert-butyl-(98-73-7)
EPA Substance Registry System p-tert-Butylbenzoic acid (98-73-7)

Safety

Symbol(GHS) GHS hazard pictogramsGHS hazard pictograms
Signal wordDanger
Hazard statements H302-H360F-H372-H412
Precautionary statements P202-P260-P264-P273-P301+P312-P308+P313
Hazard Codes  Xn,N,T
Risk Statements  20/22-62-51/53-48/20/21/22-24
Safety Statements  22-24/25-61-45-36/37/39-28A
RIDADR  UN 2811 6.1/PG 3
WGK Germany  3
RTECS  DG4708000
Autoignition Temperature >510 °C
TSCA  Yes
HazardClass  6.1
PackingGroup  III
HS Code  29163900
Hazardous Substances Data 98-73-7(Hazardous Substances Data)
Toxicity LD50 orally in Rabbit: 473 - 735 mg/kg
NFPA 704:
1
3 0

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