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2-Isopropylphenol Structure

2-Isopropylphenol

Chemical Properties

Melting point 12-16 °C (lit.)
Boiling point 212-213 °C (lit.)
Density  1.012 g/mL at 25 °C (lit.)
vapor pressure  <0.05 mm Hg ( 25 °C)
refractive index  n20/D 1.526(lit.)
FEMA  3461 | 2-ISOPROPYLPHENOL
Flash point 192 °F
storage temp.  Store below +30°C.
solubility  insoluble
form  Liquid
pka 10.49±0.10(Predicted)
color  Clear slightly yellow
Odor at 0.10 % in propylene glycol. medicinal creosote phenolic
Odor Type phenolic
biological source synthetic
Water Solubility  insoluble
JECFA Number 697
BRN  1363322
Henry's Law Constant 2.6×100 mol/(m3Pa) at 25℃, Mackay et al. (2006)
InChI 1S/C9H12O/c1-7(2)8-5-3-4-6-9(8)10/h3-7,10H,1-2H3
InChIKey CRBJBYGJVIBWIY-UHFFFAOYSA-N
SMILES CC(C)c1ccccc1O
LogP 2.82
CAS DataBase Reference 88-69-7(CAS DataBase Reference)
NIST Chemistry Reference Phenol, 2-(1-methylethyl)-(88-69-7)
EPA Substance Registry System o-Isopropylphenol (88-69-7)

Safety Information

Hazard Codes  C,Xn
Risk Statements  34-22
Safety Statements  26-36/37/39-45-28
RIDADR  UN 3145 8/PG 2
WGK Germany  3
RTECS  SL5900000
TSCA  TSCA listed
HazardClass  8
PackingGroup  II
HS Code  29071900
Storage Class 8A - Combustible corrosive hazardous materials
Hazard Classifications Acute Tox. 4 Oral
Eye Dam. 1
Skin Corr. 1B

MSDS

Usage And Synthesis

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