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3-(Hydroxymethyl)Heptan-2-One
[CAS# 65405-68-7]

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Identification
Classification Flavors and spices >> Synthetic spice >> Ketone fragrance >> Acyclic aliphatic ketone
Name 3-(Hydroxymethyl)Heptan-2-One
Synonyms 3-Methylolheptan-2-One; 2-Heptanone, 3-(Hydroxymethyl)-; 3-(Hydroxymethyl)-2-Heptanone
Molecular Formula C8H16O2
Molecular Weight 144.21
CAS Registry Number 65405-68-7
EINECS 265-739-5
SMILES C(C(C(=O)C)CCCC)O
InChI 1S/C8H16O2/c1-3-4-5-8(6-9)7(2)10/h8-9H,3-6H2,1-2H3
InChIKey MHOXVRWQBOAOAU-UHFFFAOYSA-N
Properties
Density 0.927g/cm3 (Cal.)
Boiling point 94.6°C (Expl.)
226.333°C at 760 mmHg (Cal.)
Flash point 91.418°C (Cal.)
Refractive index 1.444-1.447 (Expl.)
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