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Benzoylacetone Structure

Benzoylacetone

  • Product NameBenzoylacetone
  • CAS93-91-4
  • CBNumberCB7332014
  • MFC10H10O2
  • MW162.19
  • EINECS202-286-4
  • MDL NumberMFCD00008786
  • MOL File93-91-4.mol

Chemical Properties

Melting point: 54-56 °C(lit.)
Boiling point: 260-262°C
Density  1.09 g/mL at 25 °C(lit.)
refractive index  1.5678 (estimate)
Flash point: 260-262°C
storage temp.  Store below +30°C.
solubility  0.38g/l insoluble
form  Crystalline Flakes or Crystalline Powder
pka pK1: 8.23 (25°C)
color  Yellow
Specific Gravity 1.09
Odor at 100.00 %. acetophenone balsam woody dry opoponax vanilla
Odor Type balsamic
Water Solubility  insoluble
BRN  742413
Dielectric constant 3.8(20℃)
InChI 1S/C10H10O2/c1-8(11)7-10(12)9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey CVBUKMMMRLOKQR-UHFFFAOYSA-N
SMILES CC(=O)CC(=O)c1ccccc1
LogP 2.520 (est)
CAS DataBase Reference 93-91-4(CAS DataBase Reference)
NIST Chemistry Reference 1,3-Butanedione, 1-phenyl-(93-91-4)
EPA Substance Registry System 1,3-Butanedione, 1-phenyl- (93-91-4)

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H302
Precautionary statements  P280-P305+P351+P338
PPE Eyeshields, Gloves, type N95 (US)
Safety Statements  22-24/25
WGK Germany  3
RTECS  EK3540200
TSCA  TSCA listed
HS Code  2914399090
Storage Class 11 - Combustible Solids
Toxicity LD orl-rat: >500 mg/kg NCNSA6 5,28,53
NFPA 704:
1
0 0

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Benzoylacetone Chemical Properties,Usage,Production

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