18951-85-4

Name (R)-(+)-CITRONELLIC ACID
CAS 18951-85-4
Molecular Formula C10H18O2
MDL Number MFCD00075195
Molecular Weight 170.25
MOL File 18951-85-4.mol
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Chemical Properties

Appearance colourless liquid
Boiling point  119 °C3 mm Hg(lit.)
density  0.926 g/mL at 25 °C(lit.)
refractive index  n20/D 1.4534(lit.)
Fp  >230 °F
storage temp.  2-8°C
solubility  Chloroform (Slightly), Ether, Ethyl Acetate, Methanol (Slightly)
form  Oil
pka 4.78±0.10(Predicted)
color  Clear Pale Yellow to Pale Brown
Stability: Stable. Combustible. Incompatible with strong oxidizing agents.
Optical Rotation [α]25/D +8°, neat
JECFA Number 1221
InChI 1S/C10H18O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,9H,4,6-7H2,1-3H3,(H,11,12)/t9-/m1/s1
InChIKey GJWSUKYXUMVMGX-SECBINFHSA-N
SMILES C[C@H](CC\C=C(/C)C)CC(O)=O

Safety Data

Hazard Codes  Xn
Risk Statements 
Safety Statements 
RIDADR  UN 2810 6.1/PG 3
WGK Germany  3
HS Code  2916199590
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 4 Dermal
Skin Irrit. 2

Hazard Information

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