2111-53-7

Name (S)-(-)-3,7-DIMETHYL-6-OCTENOIC ACID
CAS 2111-53-7
Molecular Formula C10H18O2
MDL Number MFCD00134278
Molecular Weight 170.25
MOL File 2111-53-7.mol
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Chemical Properties

Appearance colourless liquid
Boiling point  115-120 °C0.4 mm Hg(lit.)
density  0.926 g/mL at 25 °C(lit.)
refractive index  n20/D 1.453(lit.)
Fp  >230 °F
form  liquid
pka 4.78±0.10(Predicted)
Stability: Stable. Combustible. Incompatible with strong oxidizing agents.
Optical Rotation [α]25/D 8°, neat
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-/m0/s1
InChIKey GJWSUKYXUMVMGX-VIFPVBQESA-N
SMILES C[C@@H](CC\C=C(/C)C)CC(O)=O

Safety Data

Hazard Codes  Xi
Risk Statements 
WGK Germany  3
Storage Class 10 - Combustible liquids
Hazard Classifications Skin Irrit. 2

Hazard Information

Spectrum Detail

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