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24817-51-4

Name FEMA 3632
CAS 24817-51-4
EINECS(EC#) 246-476-5
Molecular Formula C13H18O2
MDL Number MFCD00061557
Molecular Weight 206.28
MOL File 24817-51-4.mol
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Chemical Properties

Boiling point  305.14°C (rough estimate)
density  0.975 g/mL at 25 °C(lit.)
FEMA  3632 | PHENYLETHYL 2-METHYLBUTYRATE
refractive index  n20/D 1.486(lit.)
Fp  >230 °F
solubility  Practically insoluble in water, soluble in alcohol and oils
Odor Sweet floral and fruity odor
biological source synthetic
Odor Type floral
JECFA Number 993
InChI InChI=1S/C13H18O2/c1-3-11(2)13(14)15-10-9-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3
InChIKey KVKKTLBBYFABAZ-UHFFFAOYSA-N
SMILES C(OCCC1=CC=CC=C1)(=O)C(C)CC
LogP 3.71
EPA Substance Registry System 2-Phenylethyl 2-methylbutyrate (24817-51-4)

Safety Data

WGK Germany  2
RTECS  EK7902510
Toxicity
LD50 orl-rat: >5 g/kg FCTOD7 26,399,88

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