3572-06-3

Name 4-(4-Acetoxyphenyl)-2-butanone
CAS 3572-06-3
EINECS(EC#) 222-682-0
Molecular Formula C12H14O3
MDL Number MFCD00008704
Molecular Weight 206.24
MOL File 3572-06-3.mol

Chemical Properties

Boiling point  123-124 °C0.2 mm Hg(lit.)
density  1.099 g/mL at 25 °C(lit.)
FEMA  3652
refractive index  n20/D 1.509(lit.)
Fp  >230 °F
storage temp.  Sealed in dry,Room Temperature
form  neat
color  Colorless to Light yellow
Odor at 100.00 %. berry jam raspberry blueberry
biological source synthetic
Odor Type berry
JECFA Number 731
Merck  13,2643
BRN  1961620
Major Application flavors and fragrances
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C12H14O3/c1-9(13)3-4-11-5-7-12(8-6-11)15-10(2)14/h5-8H,3-4H2,1-2H3
InChIKey UMIKWXDGXDJQJK-UHFFFAOYSA-N
SMILES CC(=O)CCc1ccc(OC(C)=O)cc1
LogP 1.01
CAS DataBase Reference 3572-06-3(CAS DataBase Reference)
NIST Chemistry Reference 4-(p-Acetoxyphenyl)-2-butanone(3572-06-3)
EPA Substance Registry System 3572-06-3(EPA Substance)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)Health Hazard (GHS08)Environment (GHS09)
GHS07,GHS08,GHS09
Signal word  Danger
Hazard statements  H402
Precautionary statements  P273-P501
Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
WGK Germany  2
RTECS  EL8950000
Hazard Note  Irritant
TSCA  TSCA listed
HS Code  29147000
Storage Class 10 - Combustible liquids
Toxicity
LD50 in rats (mg/kg): 3038 ±1266 orally; in rabbits (mg/kg): >2025 dermally; LC50 (24 hr) in rainbow trout, bluegill sunfish (ppm): 21, 18 (Beroza)

Hazard Information

Material Safety Data Sheet(MSDS)

Questions And Answer

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