2,2-Dimethyl-3-hexanone Structure

2,2-Dimethyl-3-hexanone

Chemical Properties

Melting point -32.24°C (estimate)
Boiling point 145.85°C
Density  0.8105
vapor pressure  4.66hPa at 20℃
refractive index  1.4105
storage temp.  Storage temp. 2-8°C
form  solid
Appearance Colorless to light yellow Liquid
InChI InChI=1S/C8H16O/c1-5-6-7(9)8(2,3)4/h5-6H2,1-4H3
InChIKey PYCHXHVFOZBVEY-UHFFFAOYSA-N
SMILES CC(C)(C)C(=O)CCC
CAS DataBase Reference 5405-79-8(CAS DataBase Reference)
FDA UNII 775H4CM59G
UNSPSC Code 12352200
NACRES NA.21

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordDanger
Hazard statements H315-H319-H335
Precautionary statements P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes  Xi,F
Risk Statements  36/37/38
Safety Statements  26-36/37/39
WGK Germany  WGK 3
HazardClass  IRRITANT, FLAMMABLE
HS Code  2914199090
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
NFPA 704:
1
2 0

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