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Phenol Structure

Phenol

  • Product NamePhenol
  • CAS108-95-2
  • CBNumberCB4362168
  • MFC6H6O
    Lewis structure
  • MW94.11
  • EINECS203-632-7
  • MDL NumberMFCD00002143
  • MOL File108-95-2.mol
  • MSDS FileSDS

Chemical Properties

Melting point 40-42 °C(lit.)
Boiling point 182 °C(lit.)
Density  1.071 g/mL at 25 °C(lit.)
vapor density  3.24 (vs air)
vapor pressure  0.09 psi ( 55 °C)
refractive index  n20/D 1.53
FEMA  3223 | PHENOL
Flash point 175 °F
storage temp.  2-8°C
solubility  H2O: 50 mg/mL at 20 °C, clear, colorless
form  liquid
pka 9.89(at 20℃)
Specific Gravity 1.071
color  faintly yellow
PH 6.47(1 mM solution);5.99(10 mM solution);5.49(100 mM solution);
Odor Sweet, medicinal odor detectable at 0.06 ppm
explosive limit 1.3-9.5%(V)
Odor Threshold 0.0056ppm
Odor Type phenolic
Water Solubility  8 g/100 mL
FreezingPoint  41℃
Sensitive  Air & Light Sensitive
Merck  14,7241
JECFA Number 690
BRN  969616
Henry's Law Constant 1.09 at 5 °C (average derived from six field experiments, Lüttke and Levsen, 1997)
Dielectric constant 4.3(10℃)
Exposure limits TLV-TWA skin 5 ppm (~19 mg/m3 ) (ACGIH, MSHA, and OSHA); 10-hour TWA 5.2 ppm (~20 mg/m3 ) (NIOSH); ceiling 60 mg (15 minutes) (NIOSH); IDLH 250 ppm (NIOSH).
Stability Hygroscopic
InChIKey ISWSIDIOOBJBQZ-UHFFFAOYSA-N
LogP 1.47 at 30℃
CAS DataBase Reference 108-95-2(CAS DataBase Reference)
Substances Added to Food (formerly EAFUS) PHENOL
FDA 21 CFR 175.105; 175.300; 310.545
EWG's Food Scores 4-7
NCI Dictionary of Cancer Terms carbolic acid; phenol
FDA UNII 339NCG44TV
ATC code C05BB05,D08AE03,N01BX03,R02AA19
IARC 3 (Vol. 47, 71) 1999
NIST Chemistry Reference Phenol(108-95-2)
EPA Substance Registry System Phenol (108-95-2)

Safety

Symbol(GHS)
Signal wordDanger
Hazard statements H301+H311+H331-H314-H341-H373-H411
Precautionary statements P260-P273-P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
Hazard Codes  T,C,F,Xn
Risk Statements  23/24/25-34-48/20/21/22-68-40-39/23/24/25-11-36-20/21/22-24/25
Safety Statements  26-36/37/39-45-36/37-28A-28-24/25-1/2-36-16-7
RIDADR  UN 2821 6.1/PG 2
WGK Germany  2
RTECS  SJ3325000
8-23
Autoignition Temperature 715 °C
TSCA  Yes
HazardClass  6.1
PackingGroup  II
HS Code  29071100
Hazardous Substances Data 108-95-2(Hazardous Substances Data)
Toxicity LD50 orally in rats: 530 mg/kg (Deichmann, Witherup)
IDLA 250 ppm
NFPA 704:
2
4 0

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