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3-Octanol
[CAS# 20296-29-1]

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Identification
Classification Flavors and spices >> Synthetic spice >> Alcoholic spice >> Acyclic aliphatic alcohol
Name 3-Octanol
Synonyms (1)-Octan-3-Ol; 1-Ethylhexanol; 218405_Aldrich
Molecular Structure CAS#: 20296-29-1, 3-Octanol
Molecular Formula C8H18O
Molecular Weight 130.23
CAS Registry Number 20296-29-1
EINECS 243-713-4
SMILES C(C)CCCC(CC)O
InChI 1S/C8H18O/c1-3-5-6-7-8(9)4-2/h8-9H,3-7H2,1-2H3
InChIKey NMRPBPVERJPACX-UHFFFAOYSA-N
Properties
Density 0.8±0.1g/cm3 (Cal.)
20 (Expl.)
Melting point -45°C (Expl.)
Boiling point 168.999°C at 760 mmHg (Cal.)
174°C (Expl.)
Flash point 65.556°C (Cal.)
68°C (Expl.)
Refractive index 1.427 (Expl.)
Safety Data
Safety Code S23;S26  Details
Risk Code R36  Details
Hazard Symbol symbol  X  Details
Safety Description WARNING: Irritates skin and eyes
WARNING: Irritates lungs, eyes, skin
References
(1) Fien Van Lancker, An Adams, Barbara Delmulle, Sarah De Saeger, Antonio Moretti, Carlos Van Peteghem and Norbert De Kimpe. Use of headspace SPME-GC-MS for the analysis of the volatiles produced by indoor molds grown on different substrates, J. Environ. Monit., 2008, 10, 1127.
Market Analysis Reports
List of Reports Available for 3-Octanol
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