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(+)-CITRONELLAL Structure

(+)-CITRONELLAL

  • Product Name(+)-CITRONELLAL
  • CAS2385-77-5
  • CBNumberCB5698158
  • MFC10H18O
  • MW154.25
  • EINECS219-194-5
  • MDL NumberMFCD00067089
  • MOL File2385-77-5.mol

Chemical Properties

Melting point: 25°C
Boiling point: 207 °C (lit.)
Density  0.851 g/mL at 25 °C (lit.)
vapor pressure  33.9Pa at 25℃
refractive index  n 20/D 1.448 (lit.)
Flash point: 75 °C - closed cup
storage temp.  2-8°C
solubility  Chloroform (Sparingly), Ethyl Acetate (Slightly)
form  liquid
color  Colourless
Odor at 100.00 %. fresh herbal citrus
Odor Type herbal
Water Solubility  88mg/L
Merck  2329
BRN  1720791
InChI 1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,8,10H,4,6-7H2,1-3H3/t10-/m1/s1
InChIKey NEHNMFOYXAPHSD-SNVBAGLBSA-N
SMILES C[C@H](CC\C=C(\C)C)CC=O
LogP 3.83 at 25℃
CAS DataBase Reference 2385-77-5(CAS DataBase Reference)
EPA Substance Registry System 6-Octenal, 3,7-dimethyl-, (3R)- (2385-77-5)

Safety

Symbol(GHS)  Exclamation Mark (GHS07)
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs Respiratory system
PPE Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
TSCA  TSCA listed
HS Code  2912190090
Storage Class 10 - Combustible liquids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
REACH Registrations Active

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(+)-CITRONELLAL Chemical Properties,Usage,Production

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