104-21-2

Name Anisyl acetate
CAS 104-21-2
EINECS(EC#) 203-185-8
Molecular Formula C9H10O3
MDL Number MFCD00038509
Molecular Weight 166.17
MOL File 104-21-2.mol

Chemical Properties

Appearance clear colourless to pale yellowish liquid
Melting point  84 °C
Boiling point  137-139 °C12 mm Hg(lit.)
density  1.107 g/mL at 25 °C(lit.)
vapor pressure  12Pa at 20℃
FEMA  2098
refractive index  n20/D 1.513(lit.)
Fp  >230 °F
storage temp.  Sealed in dry,Room Temperature
form  clear liquid
color  Colorless to Almost colorless
Odor at 100.00 %. sweet powdery balsam vanilla fruity plum cherry tonka
biological source synthetic
Odor Type powdery
Water Solubility  1.982g/L(25 ºC)
JECFA Number 873
Major Application flavors and fragrances
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C10H12O3/c1-8(11)13-7-9-3-5-10(12-2)6-4-9/h3-6H,7H2,1-2H3
InChIKey HFNGYHHRRMSKEU-UHFFFAOYSA-N
SMILES COc1ccc(COC(C)=O)cc1
LogP 1.9 at 35℃
CAS DataBase Reference 104-21-2(CAS DataBase Reference)
NIST Chemistry Reference Benzenemethanol, 4-methoxy-, acetate(104-21-2)
EPA Substance Registry System 104-21-2(EPA Substance)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H317-H319-H335
Precautionary statements  P261-P280-P305+P351+P338
Hazard Codes  Xn
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
WGK Germany  2
TSCA  TSCA listed
REACH Registrations Active
HS Code  29153900
Storage Class 10 - Combustible liquids
Safety Profile
Combustible liquid. When heated to decomposition it emits acrid smoke and irritating fumes.

Raw materials And Preparation Products

Hazard Information

Material Safety Data Sheet(MSDS)

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