4'-tert-Butylacetophenone Structure

4'-tert-Butylacetophenone

Chemical Properties

Melting point 17-18 °C (dimorphic)(lit.)
Boiling point 107-108 °C5 mm Hg(lit.)
Density  0.964 g/mL at 25 °C(lit.)
refractive index  n20/D 1.52(lit.)
Flash point 86 °F
storage temp.  Sealed in dry,Room Temperature
solubility  Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
form  Liquid
Specific Gravity 0.964
color  Clear colorless
Water Solubility  insoluble
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C12H16O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-8H,1-4H3
InChIKey UYFJYGWNYQCHOB-UHFFFAOYSA-N
SMILES CC(=O)c1ccc(cc1)C(C)(C)C
LogP 3.521 (est)
CAS DataBase Reference 943-27-1(CAS DataBase Reference)
FDA UNII JAH8J5D78Y
NIST Chemistry Reference Ethanone, 1-[4-(1,1-dimethylethyl)phenyl]-(943-27-1)
EPA Substance Registry System Ethanone, 1-[4-(1,1-dimethylethyl)phenyl]- (943-27-1)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Flame (GHS02)
Signal wordWarning
Hazard statements H226-H315-H319-H335
Precautionary statements P241-P242-P261-P264b-P271-P280-P304+P340-P305+P351+P338-P312-P363-P370+P378r-P403+P233-P501c
Hazard Codes  Xn,Xi
Risk Statements  10-36/37/38-20/21/22
Safety Statements  16-29-33-36/37/39-26
RIDADR  UN 1224 3/PG 3
WGK Germany  2
TSCA  TSCA listed
HazardClass  3.2
PackingGroup  III
HS Code  29143990
Storage Class 3 - Flammable liquids
Hazard Classifications Flam. Liq. 3
NFPA 704:
2
2 0

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