3'-Methylacetophenone Structure

3'-Methylacetophenone

Chemical Properties

Melting point -9 °C (lit.)
Boiling point 218-220 °C (lit.)
Density  0.986 g/mL at 25 °C (lit.)
refractive index  n20/D 1.529(lit.)
Flash point 185 °F
storage temp.  Inert atmosphere,Room Temperature
solubility  Difficult to mix.
form  Liquid
Specific Gravity 0.986
color  Clear colorless to slightly yellow
BRN  956637
Henry's Law Constant 1.5×100 mol/(m3Pa) at 25℃, Ji et al. (2008)
InChI 1S/C9H10O/c1-7-4-3-5-9(6-7)8(2)10/h3-6H,1-2H3
InChIKey FSPSELPMWGWDRY-UHFFFAOYSA-N
SMILES CC(=O)c1cccc(C)c1
LogP 2.150
CAS DataBase Reference 585-74-0(CAS DataBase Reference)
FDA UNII V3KL17Y68N
NIST Chemistry Reference Ethanone, 1-(3-methylphenyl)-(585-74-0)
EPA Substance Registry System Ethanone, 1-(3-methylphenyl)- (585-74-0)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) GHS hazard pictograms
Signal wordWarning
Hazard statements H302-H227
Precautionary statements P210e-P264-P280a-P301+P312a-P403+P235-P501a
Hazard Codes  Xn
Risk Statements  22
Safety Statements  23-24/25
WGK Germany  3
HS Code  29143990
Storage Class 10 - Combustible liquids
Hazard Classifications Acute Tox. 4 Oral
NFPA 704:
2
2 0

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