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3-Phenylpropyl acetate Structure

3-Phenylpropyl acetate

  • Product Name3-Phenylpropyl acetate
  • CAS122-72-5
  • CBNumberCB6128366
  • MFC11H14O2
  • MW178.23
  • EINECS204-569-8
  • MDL NumberMFCD00026216
  • MOL File122-72-5.mol

Chemical Properties

Melting point: -60 °C
Boiling point: 245 °C
Density  1.02
vapor pressure  <0.01 hPa (20 °C)
FEMA  2890 | 3-PHENYLPROPYL ACETATE
refractive index  1.50
Flash point: 130 °C
storage temp.  Store below +30°C.
solubility  0.69g/l
form  clear liquid
color  Colorless to Almost colorless
Odor at 100.00 %. sweet balsam storax spicy cinnamon
Odor Type balsamic
biological source synthetic
Water Solubility  392.148mg/L at 25℃
JECFA Number 638
Major Application flavors and fragrances
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C11H14O2/c1-10(12)13-9-5-8-11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3
InChIKey JRJGKUTZNBZHNK-UHFFFAOYSA-N
SMILES CC(=O)OCCCc1ccccc1
LogP 3.06
CAS DataBase Reference 122-72-5(CAS DataBase Reference)
EPA Substance Registry System Benzenepropanol, acetate (122-72-5)

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P305+P351+P338
Safety Statements  24/25
WGK Germany  2
RTECS  UB9000000
Autoignition Temperature 445 °C
TSCA  TSCA listed
HS Code  2915390090
Storage Class 10 - Combustible liquids
Toxicity LD50 orally in Rabbit: 4700 mg/kg
REACH Registrations Inactive
NFPA 704:
0
0 0

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3-Phenylpropyl acetate Chemical Properties,Usage,Production

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