4-Ethyl-2-methoxyphenol Structure

4-Ethyl-2-methoxyphenol

Chemical Properties

Melting point 15 °C (59 °F; 288 K)
Boiling point 235.1 °C (455.2 °F; 508.2 K)
Density  1064 kg/m3 (20 °C)
refractive index  1.53
FLAVIS Number 04.008 | 4-Ethylguaiacol
FEMA  2436 | 4-ETHYLGUAIACOL
Flash point 108 °C
storage temp.  2-8°C
solubility  Chloroform (Slightly), Methanol (Slightly)
pka 10.31±0.18(Predicted)
form  liquid
color  Colorless
Specific Gravity 1.06
Odor Warm, sweet and spicy-medicinal, very powerful odor
biological source synthetic
Odor Type spicy
JECFA Number 716
BRN  2045329
Henry's Law Constant 5.5×100 mol/(m3Pa) at 25℃, McFall et al. (2020)
Major Application flavors and fragrances
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C9H12O2/c1-3-7-4-5-8(10)9(6-7)11-2/h4-6,10H,3H2,1-2H3
InChIKey CHWNEIVBYREQRF-UHFFFAOYSA-N
SMILES CCc1ccc(O)c(OC)c1
LogP 2.18
CAS DataBase Reference 2785-89-9(CAS DataBase Reference)
Substances Added to Food (formerly EAFUS) 4-ETHYLGUAIACOL
FDA 21 CFR 172.515
EWG's Food Scores 1
FDA UNII C9NFD83BJ5
NIST Chemistry Reference Phenol, 4-ethyl-2-methoxy-(2785-89-9)
EPA Substance Registry System Phenol, 4-ethyl-2-methoxy- (2785-89-9)
UNSPSC Code 85151701
NACRES NA.24

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes  Xi,Xn
Risk Statements  36/37/38-22
Safety Statements  26-36-37/39
RIDADR  2810
WGK Germany  2
TSCA  TSCA listed
HazardClass  6.1(b)
PackingGroup  III
HS Code  29071990
Storage Class 10 - Combustible liquids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
NFPA 704:
0
2 0

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