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2-n-Heptylcyclopentanone Structure

2-n-Heptylcyclopentanone

  • Product Name2-n-Heptylcyclopentanone
  • CAS137-03-1
  • CBNumberCB4192169
  • MFC12H22O
  • MW182.3
  • EINECS205-273-1
  • MDL NumberMFCD00019315
  • MOL File137-03-1.mol

Chemical Properties

Boiling point: 264 °C
Density  0.89
vapor pressure  2.4Pa at 24℃
refractive index  1.4526 (589.3 nm 20℃)
storage temp.  Inert atmosphere,Room Temperature
solubility  Practically insoluble in water, soluble in alcohol and oils.
form  clear liquid
color  Colorless to Almost colorless
Odor at 100.00 %. fresh fruity peach isojasmone oily tropical
Odor Type fruity
Water Solubility  31mg/L at 24℃
Cosmetics Ingredients Functions FRAGRANCE
PERFUMING
InChI InChI=1S/C12H22O/c1-2-3-4-5-6-8-11-9-7-10-12(11)13/h11H,2-10H2,1H3
InChIKey PJXHBTZLHITWFX-UHFFFAOYSA-N
SMILES C1(=O)CCCC1CCCCCCC
LogP 3.8 at 25℃
CAS DataBase Reference 137-03-1(CAS DataBase Reference)
EPA Substance Registry System Cyclopentanone, 2-heptyl- (137-03-1)
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Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H303+H313-H316
Precautionary statements  P312-P332+P313
Risk Statements  36/37/38
Safety Statements  26-37
RTECS  GY4950000
TSCA  TSCA listed
HS Code  2914.29.5000
Toxicity The acute oral LD50 value in rats was reported as > 5 g/kg (Shelanski, 1973). The acute dermal LD50 value in rabbits was reported as 5 g/kg (Shelanski, 1973).
REACH Registrations Active
NFPA 704:
0
2 0

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