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4-Chloro-3-methylphenol Structure

4-Chloro-3-methylphenol

Chemical Properties

Melting point 63-65 °C (lit.)
Boiling point 235 °C (lit.)
Density  1.370
vapor pressure  <0.1 hPa (20 °C)
refractive index  1.5449 (estimate)
Flash point 118 °C
storage temp.  Store below +30°C.
solubility  methanol: soluble1g/10 mL, clear, colorless
form  Tablets
pka pKa 9.55(t = 25) (Uncertain)
color  White
PH 6.5 (1g/l, H2O, 20℃)
Water Solubility  4 g/L (20 ºC)
Merck  14,2133
BRN  1237629
Henry's Law Constant 2.5(x 10-6 atm?m3/mol)at 20 °C (calculated, Mabey et al., 1982)
Stability Stable. Incompatible with brass, oxidizing agents, copper, copper alloys.
InChIKey CFKMVGJGLGKFKI-UHFFFAOYSA-N
LogP 3.100
Indirect Additives used in Food Contact Substances 4-CHLORO-3-METHYLPHENOL
FDA 21 CFR 175.105; 176.200
CAS DataBase Reference 59-50-7(CAS DataBase Reference)
EWG's Food Scores 5
FDA UNII 36W53O7109
NIST Chemistry Reference Phenol, 4-chloro-3-methyl-(59-50-7)
EPA Substance Registry System p-Chloro-m-cresol (59-50-7)

Safety

Symbol(GHS)
Signal wordDanger
Hazard statements H302+H312-H314-H317-H335-H410
Precautionary statements P260-P273-P280-P301+P312-P303+P361+P353-P305+P351+P338
Hazard Codes  Xn,N,T,F
Risk Statements  21/22-41-43-50-39/23/24/25-23/24/25-11-38
Safety Statements  26-36/37/39-61-45-36/37-16-7-28
RIDADR  UN 3077 9/PG 3
WGK Germany  2
RTECS  GO7100000
Autoignition Temperature 590 °C
TSCA  Yes
HazardClass  6.1(a)
PackingGroup  II
HS Code  29081000
Hazardous Substances Data 59-50-7(Hazardous Substances Data)
Toxicity LD50 orally in Rabbit: 1830 mg/kg LD50 dermal Rat > 2000 mg/kg
NFPA 704:
1
3 0

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